AF29387
22106-33-8 | 4-(1H-Pyrrol-1-yl)benzoic acid
Manufacturer: A2B Chem
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CatalogNumber
AF29387
ChemicalName
4-(1H-Pyrrol-1-yl)benzoic acid
CasNumber
22106-33-8
MolecularFormula
C11H9NO2
MolecularWeight
187.19466000000003
MdlNumber
MFCD00082569
Smiles
OC(=O)c1ccc(cc1)n1cccc1
Complexity
203
Covalently-bondedUnitCount
1
HeavyAtomCount
14
HydrogenBondAcceptorCount
2
HydrogenBondDonorCount
1
RotatableBondCount
2
Xlogp3
2.6
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CatalogNumber: AF29387
ChemicalName: 4-(1H-Pyrrol-1-yl)benzoic acid
CasNumber: 22106-33-8
MolecularFormula: C11H9NO2
MolecularWeight: 187.19466000000003
MdlNumber: MFCD00082569
Smiles: OC(=O)c1ccc(cc1)n1cccc1
Complexity: 203
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 2.6
CatalogNumber:
AF29387
ChemicalName:
4-(1H-Pyrrol-1-yl)benzoic acid
CasNumber:
22106-33-8
MolecularFormula:
C11H9NO2
MolecularWeight:
187.19466000000003
MdlNumber:
MFCD00082569
Smiles:
OC(=O)c1ccc(cc1)n1cccc1
Complexity:
203
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
2.6
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: NNc1ccc(cc1F)Br
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
NNc1ccc(cc1F)Br
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AF29389
ChemicalName: 1-Phenyl-1H-pyrrole-2-carbaldehyde
CasNumber: 30186-39-1
MolecularFormula: C11H9NO
MolecularWeight: 171.1953
MdlNumber: MFCD00457595
Smiles: O=Cc1cccn1c1ccccc1
Complexity: 175
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 1
HydrogenBondDonorCount: __
RotatableBondCount: 2
Xlogp3: 2.1
CatalogNumber:
AF29389
ChemicalName:
1-Phenyl-1H-pyrrole-2-carbaldehyde
CasNumber:
30186-39-1
MolecularFormula:
C11H9NO
MolecularWeight:
171.1953
MdlNumber:
MFCD00457595
Smiles:
O=Cc1cccn1c1ccccc1
Complexity:
175
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
1
HydrogenBondDonorCount:
__
RotatableBondCount:
2
Xlogp3:
2.1
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__