AI11788
118420-23-8 | 3-(6-Methyl-3-pyridinyl)propanoic acid
Manufacturer: A2B Chem
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CatalogNumber
AI11788
ChemicalName
3-(6-Methyl-3-pyridinyl)propanoic acid
CasNumber
118420-23-8
MolecularFormula
C9H11NO2
MolecularWeight
165.18914
MdlNumber
MFCD18259981
Smiles
OC(=O)CCc1ccc(nc1)C
Complexity
159
Covalently-bondedUnitCount
1
HeavyAtomCount
12
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
3
Xlogp3
1
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CatalogNumber: AI11788
ChemicalName: 3-(6-Methyl-3-pyridinyl)propanoic acid
CasNumber: 118420-23-8
MolecularFormula: C9H11NO2
MolecularWeight: 165.18914
MdlNumber: MFCD18259981
Smiles: OC(=O)CCc1ccc(nc1)C
Complexity: 159
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 3
Xlogp3: 1
CatalogNumber:
AI11788
ChemicalName:
3-(6-Methyl-3-pyridinyl)propanoic acid
CasNumber:
118420-23-8
MolecularFormula:
C9H11NO2
MolecularWeight:
165.18914
MdlNumber:
MFCD18259981
Smiles:
OC(=O)CCc1ccc(nc1)C
Complexity:
159
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
3
Xlogp3:
1
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Smiles: Fc1cc(F)cc(c1)c1cc(F)ccc1C(=O)O
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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Smiles:
Fc1cc(F)cc(c1)c1cc(F)ccc1C(=O)O
Complexity:
__
Covalently-bondedUnitCount:
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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Smiles: COc1ccccc1c1cc(F)ccc1C(=O)O
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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CasNumber:
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MolecularFormula:
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MdlNumber:
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Smiles:
COc1ccccc1c1cc(F)ccc1C(=O)O
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
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MolecularFormula: __
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Smiles: Fc1ccc(c(c1)C(=O)O)c1cc(C)cc(c1)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Fc1ccc(c(c1)C(=O)O)c1cc(C)cc(c1)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__