AB33093
27825-20-3 | Methyl 3-hydroxypyrazine-2-carboxylate
Manufacturer: A2B Chem
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CatalogNumber
AB33093
ChemicalName
Methyl 3-hydroxypyrazine-2-carboxylate
CasNumber
27825-20-3
MolecularFormula
C6H6N2O3
MolecularWeight
154.12344
MdlNumber
MFCD03093338
Smiles
COC(=O)c1ncc[nH]c1=O
Complexity
255
Covalently-bondedUnitCount
1
HeavyAtomCount
11
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
1
RotatableBondCount
2
Xlogp3
-0.4
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CatalogNumber: AB33093
ChemicalName: Methyl 3-hydroxypyrazine-2-carboxylate
CasNumber: 27825-20-3
MolecularFormula: C6H6N2O3
MolecularWeight: 154.12344
MdlNumber: MFCD03093338
Smiles: COC(=O)c1ncc[nH]c1=O
Complexity: 255
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: -0.4
CatalogNumber:
AB33093
ChemicalName:
Methyl 3-hydroxypyrazine-2-carboxylate
CasNumber:
27825-20-3
MolecularFormula:
C6H6N2O3
MolecularWeight:
154.12344
MdlNumber:
MFCD03093338
Smiles:
COC(=O)c1ncc[nH]c1=O
Complexity:
255
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
-0.4
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OCC1CCCN1C(=O)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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MolecularFormula:
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Smiles:
OCC1CCCN1C(=O)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
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ChemicalName: __
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Smiles: COc1cc(OC)c2c(c1)oc(c(c2=O)OC)c1ccccc1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
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__
ChemicalName:
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CasNumber:
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MolecularFormula:
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MolecularWeight:
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MdlNumber:
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Smiles:
COc1cc(OC)c2c(c1)oc(c(c2=O)OC)c1ccccc1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
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Smiles: OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cc(OP(=O)(OP(=O)(O)[O-])[O-])c(=O)[nH]c1=O.[Na+].[Na+]
Complexity: 665
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cc(OP(=O)(OP(=O)(O)[O-])[O-])c(=O)[nH]c1=O.[Na+].[Na+]
Complexity:
665
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__