AF56587
3314-30-5 | 1H-Benzoimidazole-2-carboxaldehyde
Manufacturer: A2B Chem
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CatalogNumber
AF56587
ChemicalName
1H-Benzoimidazole-2-carboxaldehyde
CasNumber
3314-30-5
MolecularFormula
C8H6N2O
MolecularWeight
146.14604000000003
MdlNumber
MFCD00228045
Smiles
O=Cc1nc2c([nH]1)cccc2
Complexity
160
Covalently-bondedUnitCount
1
HeavyAtomCount
11
HydrogenBondAcceptorCount
2
HydrogenBondDonorCount
1
RotatableBondCount
1
Xlogp3
1.1
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CatalogNumber: AF56587
ChemicalName: 1H-Benzoimidazole-2-carboxaldehyde
CasNumber: 3314-30-5
MolecularFormula: C8H6N2O
MolecularWeight: 146.14604000000003
MdlNumber: MFCD00228045
Smiles: O=Cc1nc2c([nH]1)cccc2
Complexity: 160
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 1.1
CatalogNumber:
AF56587
ChemicalName:
1H-Benzoimidazole-2-carboxaldehyde
CasNumber:
3314-30-5
MolecularFormula:
C8H6N2O
MolecularWeight:
146.14604000000003
MdlNumber:
MFCD00228045
Smiles:
O=Cc1nc2c([nH]1)cccc2
Complexity:
160
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
1.1
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1c[nH]cn1)N
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1c[nH]cn1)N
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Clc1ccc(c(c1)N)Oc1ccc(cc1S(=O)(=O)O)Cl
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Clc1ccc(c(c1)N)Oc1ccc(cc1S(=O)(=O)O)Cl
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AF56590
ChemicalName: Cyclohexylamine benzoate
CasNumber: 3129-92-8
MolecularFormula: C13H19NO2
MolecularWeight: 221.2955
MdlNumber: MFCD01744678
Smiles: OC(=O)c1ccccc1.NC1CCCCC1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
AF56590
ChemicalName:
Cyclohexylamine benzoate
CasNumber:
3129-92-8
MolecularFormula:
C13H19NO2
MolecularWeight:
221.2955
MdlNumber:
MFCD01744678
Smiles:
OC(=O)c1ccccc1.NC1CCCCC1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__