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Ácido barbitúrico

Ácido barbitúrico

El ácido barbitúrico es el compuesto principal de los fármacos barbitúricos; un ácido orgánico basado en un esqueleto heterocíclico de pirimidina. El compuesto se puede utilizar en la reacción de condensación de Knoevenagel para sintetizar varios fármacos depresores del sistema nervioso central.
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1 – 12 de 12 resultados
1

Ácido barbitúrico, +99 %, Thermo Scientific Chemicals

CAS: 67-52-7 Fórmula molecular: C4H4N2O3 Peso molecular (g/mol): 128.09 Número MDL: MFCD00006666 Clave InChI: HNYOPLTXPVRDBG-UHFFFAOYSA-N Sinónimo: malonylurea,pyrimidine-2,4,6 1h,3h,5h-trione,barbiturate,6-hydroxyuracil,2,4,6 1h,3h,5h-pyrimidinetrione,malonylharnstoff,2,4,6-pyrimidinetrione,barbituric acid,2,4,6-trihydroxypyrimidine,pyrimidinetrione PubChem CID: 6211 ChEBI: CHEBI:16294 Nombre IUPAC: 1,3-diazinano-2,4,6-triona SMILES: O=C1CC(=O)NC(=O)N1

Sinónimo malonylurea,pyrimidine-2,4,6 1h,3h,5h-trione,barbiturate,6-hydroxyuracil,2,4,6 1h,3h,5h-pyrimidinetrione,malonylharnstoff,2,4,6-pyrimidinetrione,barbituric acid,2,4,6-trihydroxypyrimidine,pyrimidinetrione
Clave InChI HNYOPLTXPVRDBG-UHFFFAOYSA-N
PubChem CID 6211
Fórmula molecular C4H4N2O3
CAS 67-52-7
ChEBI CHEBI:16294
Peso molecular (g/mol) 128.09
Número MDL MFCD00006666
SMILES O=C1CC(=O)NC(=O)N1
Nombre IUPAC 1,3-diazinano-2,4,6-triona
2

Murexida, Thermo Scientific Chemicals

CAS: 3051-09-0 Fórmula molecular: C8H3N5O6-2 Peso molecular (g/mol): 265.141 Número MDL: MFCD00012777 Clave InChI: MUMMBXDKKJEASE-UHFFFAOYSA-L Sinónimo: murexide,ammonium purpurate acid,6-oxo-5-2,4,6-trioxo-1,3-diazinan-5-ylidene amino-1h-pyrimidine-2,4-diolate,5-hexahydro-2,4,6-trioxo-5-pyrimidinyl imino-2,4,6 1h,3h,5h-pyrimidinetrione ammonium salt,6-oxidanylidene-5-2,4,6-tris oxidanylidene-1,3-diazinan-5-ylidene amino-1h-pyrimidine-2,4-diolate PubChem CID: 51381221 Nombre IUPAC: 6-oxo-5-[(2,4,6-trioxo-1,3-diazinan-5-ilideno)amino]-1H-pirimidina-2,4-diolato SMILES: C1(=C(N=C(NC1=O)[O-])[O-])N=C2C(=O)NC(=O)NC2=O

Sinónimo murexide,ammonium purpurate acid,6-oxo-5-2,4,6-trioxo-1,3-diazinan-5-ylidene amino-1h-pyrimidine-2,4-diolate,5-hexahydro-2,4,6-trioxo-5-pyrimidinyl imino-2,4,6 1h,3h,5h-pyrimidinetrione ammonium salt,6-oxidanylidene-5-2,4,6-tris oxidanylidene-1,3-diazinan-5-ylidene amino-1h-pyrimidine-2,4-diolate
Clave InChI MUMMBXDKKJEASE-UHFFFAOYSA-L
PubChem CID 51381221
Fórmula molecular C8H3N5O6-2
CAS 3051-09-0
Peso molecular (g/mol) 265.141
Número MDL MFCD00012777
SMILES C1(=C(N=C(NC1=O)[O-])[O-])N=C2C(=O)NC(=O)NC2=O
Nombre IUPAC 6-oxo-5-[(2,4,6-trioxo-1,3-diazinan-5-ilideno)amino]-1H-pirimidina-2,4-diolato
3

1,3-ácido dimetilbarbitúrico, 99 % (peso seco), <6 % de agua, Thermo Scientific Chemicals

CAS: 769-42-6 Fórmula molecular: C6H8N2O3 Peso molecular (g/mol): 156.141 Número MDL: MFCD00006675 Clave InChI: VVSASNKOFCZVES-UHFFFAOYSA-N Sinónimo: 1,3-dimethylbarbituric acid,n,n'-dimethylbarbituric acid,2,4,6 1h,3h,5h-pyrimidinetrione, 1,3-dimethyl,1,3-dimethylbarbituricacid,barbituric acid, 1,3-dimethyl,1,3-dimethylpyrimidine-2,4,6 1h,3h,5h-trione,1,3-dimethyl barbituric acid,1,3-dimethyl-2,4,6 1h,3h,5h-pyrimidinetrione,1,3-dimethyl-2,4,6 1h,3h,5h pyrimidinetrione,1,3-dimethyl-1,3,5-trihydropyrimidine-2,4,6-trione PubChem CID: 69860 Nombre IUPAC: 1,3-dimetil-1,3-diazinano-2,4,6-triona SMILES: CN1C(=O)CC(=O)N(C1=O)C

Sinónimo 1,3-dimethylbarbituric acid,n,n'-dimethylbarbituric acid,2,4,6 1h,3h,5h-pyrimidinetrione, 1,3-dimethyl,1,3-dimethylbarbituricacid,barbituric acid, 1,3-dimethyl,1,3-dimethylpyrimidine-2,4,6 1h,3h,5h-trione,1,3-dimethyl barbituric acid,1,3-dimethyl-2,4,6 1h,3h,5h-pyrimidinetrione,1,3-dimethyl-2,4,6 1h,3h,5h pyrimidinetrione,1,3-dimethyl-1,3,5-trihydropyrimidine-2,4,6-trione
Clave InChI VVSASNKOFCZVES-UHFFFAOYSA-N
PubChem CID 69860
Fórmula molecular C6H8N2O3
CAS 769-42-6
Peso molecular (g/mol) 156.141
Número MDL MFCD00006675
SMILES CN1C(=O)CC(=O)N(C1=O)C
Nombre IUPAC 1,3-dimetil-1,3-diazinano-2,4,6-triona
5

Ácido 1-Bencilo-5-fenilbarbitúrico, +98 %, Thermo Scientific Chemicals

CAS: 72846-00-5 Fórmula molecular: C17H14N2O3 Peso molecular (g/mol): 294.31 Número MDL: MFCD00082750 Clave InChI: KCWWCWMGJOWTMY-UHFFFAOYNA-N Sinónimo: 1-benzyl-5-phenylbarbituric acid,1-benzyl-5-phenylpyrimidine-2,4,6 1h,3h,5h-trione,benzyl-5-phenylbarbituric acid,2,4,6 1h,3h,5h-pyrimidinetrione, 5-phenyl-1-phenylmethyl,1-phenylmethyl-5-phenyl-barbituric acid,5-phenyl-1-benzyl-1,3,5-trihydropyrimidine-2,4,6-trione,acmc-1bb85,1-benzyl-5-phenylbarbiturate,1-benzyl-5-phenylbarbituricacid,1-benzyl-5-phenylbarbituric acid 5g PubChem CID: 166340 Nombre IUPAC: 1-bencil-5-fenil-1,3-diazinano-2,4,6-triona SMILES: O=C1NC(=O)N(CC2=CC=CC=C2)C(=O)C1C1=CC=CC=C1

Sinónimo 1-benzyl-5-phenylbarbituric acid,1-benzyl-5-phenylpyrimidine-2,4,6 1h,3h,5h-trione,benzyl-5-phenylbarbituric acid,2,4,6 1h,3h,5h-pyrimidinetrione, 5-phenyl-1-phenylmethyl,1-phenylmethyl-5-phenyl-barbituric acid,5-phenyl-1-benzyl-1,3,5-trihydropyrimidine-2,4,6-trione,acmc-1bb85,1-benzyl-5-phenylbarbiturate,1-benzyl-5-phenylbarbituricacid,1-benzyl-5-phenylbarbituric acid 5g
Clave InChI KCWWCWMGJOWTMY-UHFFFAOYNA-N
PubChem CID 166340
Fórmula molecular C17H14N2O3
CAS 72846-00-5
Peso molecular (g/mol) 294.31
Número MDL MFCD00082750
SMILES O=C1NC(=O)N(CC2=CC=CC=C2)C(=O)C1C1=CC=CC=C1
Nombre IUPAC 1-bencil-5-fenil-1,3-diazinano-2,4,6-triona
6

Aloxan monohidrato, 98 %, Thermo Scientific Chemicals

CAS: 3237-50-1 Fórmula molecular: C4H4N2O5 Peso molecular (g/mol): 160.085 Número MDL: MFCD00149399 Clave InChI: ZIIHZVKHFWOENY-UHFFFAOYSA-N Sinónimo: barbituric acid, 5,5-dihydroxy,2,4,6 1h,3h,5h-pyrimidinetrione, 5,5-dihydroxy,unii-o2aap9f8b6,5,5-dihydroxybarbituric acid,ccris 5957,mesoxalylurea monohydrate,2,4,5,6 1h,3h-pyrimidinetetrone hydrate,5,5-dihydroxyperhydropyrimidinetrione,5,5-dihydroxy-2,4,6 1h,3h,5h-pyrimidinetrione,o2aap9f8b6 PubChem CID: 312231 Nombre IUPAC: 5,5-dihidroxi-1,3-diazinano-2,4,6-triona SMILES: C1(=O)C(C(=O)NC(=O)N1)(O)O

Sinónimo barbituric acid, 5,5-dihydroxy,2,4,6 1h,3h,5h-pyrimidinetrione, 5,5-dihydroxy,unii-o2aap9f8b6,5,5-dihydroxybarbituric acid,ccris 5957,mesoxalylurea monohydrate,2,4,5,6 1h,3h-pyrimidinetetrone hydrate,5,5-dihydroxyperhydropyrimidinetrione,5,5-dihydroxy-2,4,6 1h,3h,5h-pyrimidinetrione,o2aap9f8b6
Clave InChI ZIIHZVKHFWOENY-UHFFFAOYSA-N
PubChem CID 312231
Fórmula molecular C4H4N2O5
CAS 3237-50-1
Peso molecular (g/mol) 160.085
Número MDL MFCD00149399
SMILES C1(=O)C(C(=O)NC(=O)N1)(O)O
Nombre IUPAC 5,5-dihidroxi-1,3-diazinano-2,4,6-triona
7

5,5-ácido dibromobarbitúrico, 97 %, Thermo Scientific Chemicals

CAS: 511-67-1 Fórmula molecular: C4H2Br2N2O3 Peso molecular (g/mol): 285.88 Número MDL: MFCD00010595 Clave InChI: AMATXUCYHHHHHB-UHFFFAOYSA-N Sinónimo: 5,5-dibromobarbituric acid,dibromin,5,5-dibromopyrimidine-2,4,6 1h,3h,5h-trione,2,4,6 1h,3h,5h-pyrimidinetrione, 5,5-dibromo,dibrombarbitursaure,dibromobarbituric acid,acmc-20am7j,barbituric acid,5-dibromo,diethyl trimethylsilylphosphate PubChem CID: 94877 Nombre IUPAC: 5,5-dibromo-1,3-diazinano-2,4,6-triona SMILES: BrC1(Br)C(=O)NC(=O)NC1=O

Sinónimo 5,5-dibromobarbituric acid,dibromin,5,5-dibromopyrimidine-2,4,6 1h,3h,5h-trione,2,4,6 1h,3h,5h-pyrimidinetrione, 5,5-dibromo,dibrombarbitursaure,dibromobarbituric acid,acmc-20am7j,barbituric acid,5-dibromo,diethyl trimethylsilylphosphate
Clave InChI AMATXUCYHHHHHB-UHFFFAOYSA-N
PubChem CID 94877
Fórmula molecular C4H2Br2N2O3
CAS 511-67-1
Peso molecular (g/mol) 285.88
Número MDL MFCD00010595
SMILES BrC1(Br)C(=O)NC(=O)NC1=O
Nombre IUPAC 5,5-dibromo-1,3-diazinano-2,4,6-triona
8

(1R)-endo-(+)-fenchil alcohol, 96 %, Thermo Scientific Chemicals

CAS: 2217-02-9 Número MDL: MFCD00003760

CAS 2217-02-9
Número MDL MFCD00003760
9

Monohidrato de aloxano, 98 %, Thermo Scientific Chemicals

CAS: 3237-50-1 Fórmula molecular: C4H4N2O5 Número MDL: MFCD00149399 Clave InChI: ZIIHZVKHFWOENY-UHFFFAOYSA-N

Clave InChI ZIIHZVKHFWOENY-UHFFFAOYSA-N
Fórmula molecular C4H4N2O5
CAS 3237-50-1
Número MDL MFCD00149399
11

Isopropylbarbituric acid, 97%, Thermo Scientific™

CAS: 7391-69-7 Fórmula molecular: C7H10N2O3 Peso molecular (g/mol): 170.168 Clave InChI: GFPIGNBQTXNNAG-UHFFFAOYSA-N Sinónimo: 5-isopropylbarbituric acid,2,4,6 1h,3h,5h-pyrimidinetrione, 5-1-methylethyl,5-isopropylpyrimidine-2,4,6 1h,3h,5h-trione,5-isopropyl barbituric acid,barbituric acid, 5-isopropyl,barbituric acid, 5-ipr,2,6 1h,3h,5h-pyrimidinetrione, 5-1-methylethyl,5-1-methylethyl pyrimidine-2,4,6 1h,3h,5h-trione PubChem CID: 81874 Nombre IUPAC: 5-propan-2-il-1,3-diazinano-2,4,6-triona SMILES: CC(C)C1C(=O)NC(=O)NC1=O

Sinónimo 5-isopropylbarbituric acid,2,4,6 1h,3h,5h-pyrimidinetrione, 5-1-methylethyl,5-isopropylpyrimidine-2,4,6 1h,3h,5h-trione,5-isopropyl barbituric acid,barbituric acid, 5-isopropyl,barbituric acid, 5-ipr,2,6 1h,3h,5h-pyrimidinetrione, 5-1-methylethyl,5-1-methylethyl pyrimidine-2,4,6 1h,3h,5h-trione
Clave InChI GFPIGNBQTXNNAG-UHFFFAOYSA-N
PubChem CID 81874
Fórmula molecular C7H10N2O3
CAS 7391-69-7
Peso molecular (g/mol) 170.168
SMILES CC(C)C1C(=O)NC(=O)NC1=O
Nombre IUPAC 5-propan-2-il-1,3-diazinano-2,4,6-triona
12

5-ácido isopropilbarbitúrico, 98 %, Thermo Scientific™

CAS: 7391-69-7 Fórmula molecular: C7H10N2O3 Peso molecular (g/mol): 170.168 Número MDL: MFCD00051832 Clave InChI: GFPIGNBQTXNNAG-UHFFFAOYSA-N Sinónimo: 5-isopropylbarbituric acid,2,4,6 1h,3h,5h-pyrimidinetrione, 5-1-methylethyl,5-isopropylpyrimidine-2,4,6 1h,3h,5h-trione,5-isopropyl barbituric acid,barbituric acid, 5-isopropyl,barbituric acid, 5-ipr,2,6 1h,3h,5h-pyrimidinetrione, 5-1-methylethyl,5-1-methylethyl pyrimidine-2,4,6 1h,3h,5h-trione PubChem CID: 81874 Nombre IUPAC: 5-propan-2-il-1,3-diazinano-2,4,6-triona SMILES: CC(C)C1C(=O)NC(=O)NC1=O

Sinónimo 5-isopropylbarbituric acid,2,4,6 1h,3h,5h-pyrimidinetrione, 5-1-methylethyl,5-isopropylpyrimidine-2,4,6 1h,3h,5h-trione,5-isopropyl barbituric acid,barbituric acid, 5-isopropyl,barbituric acid, 5-ipr,2,6 1h,3h,5h-pyrimidinetrione, 5-1-methylethyl,5-1-methylethyl pyrimidine-2,4,6 1h,3h,5h-trione
Clave InChI GFPIGNBQTXNNAG-UHFFFAOYSA-N
PubChem CID 81874
Fórmula molecular C7H10N2O3
CAS 7391-69-7
Peso molecular (g/mol) 170.168
Número MDL MFCD00051832
SMILES CC(C)C1C(=O)NC(=O)NC1=O
Nombre IUPAC 5-propan-2-il-1,3-diazinano-2,4,6-triona