AB69477
40507-59-3 | 4-Nitro-1h-imidazole-5-carboxylic acid
Manufacturer: A2B Chem
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CatalogNumber
AB69477
ChemicalName
4-Nitro-1h-imidazole-5-carboxylic acid
CasNumber
40507-59-3
MolecularFormula
C4H3N3O4
MolecularWeight
157.0843
MdlNumber
MFCD03013324
Smiles
[O-][N+](=O)c1nc[nH]c1C(=O)O
Complexity
188
Covalently-bondedUnitCount
1
HeavyAtomCount
11
HydrogenBondAcceptorCount
5
HydrogenBondDonorCount
2
RotatableBondCount
1
Xlogp3
0.1
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CatalogNumber: AB69477
ChemicalName: 4-Nitro-1h-imidazole-5-carboxylic acid
CasNumber: 40507-59-3
MolecularFormula: C4H3N3O4
MolecularWeight: 157.0843
MdlNumber: MFCD03013324
Smiles: [O-][N+](=O)c1nc[nH]c1C(=O)O
Complexity: 188
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 2
RotatableBondCount: 1
Xlogp3: 0.1
CatalogNumber:
AB69477
ChemicalName:
4-Nitro-1h-imidazole-5-carboxylic acid
CasNumber:
40507-59-3
MolecularFormula:
C4H3N3O4
MolecularWeight:
157.0843
MdlNumber:
MFCD03013324
Smiles:
[O-][N+](=O)c1nc[nH]c1C(=O)O
Complexity:
188
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
2
RotatableBondCount:
1
Xlogp3:
0.1
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=N(=O)c1ccc2c(c1)c(=O)oc(=O)[nH]2
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=N(=O)c1ccc2c(c1)c(=O)oc(=O)[nH]2
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OC(=O)c1cc(cc(c1)C(=O)O)[N+](=O)[O-]
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OC(=O)c1cc(cc(c1)C(=O)O)[N+](=O)[O-]
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCOC(=O)c1cc(cc(c1)C(=O)O)[N+](=O)[O-]
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCOC(=O)c1cc(cc(c1)C(=O)O)[N+](=O)[O-]
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__