AH20892
66735-01-1 | 2-(4-Bromobenzyl)propanoic acid
Manufacturer: A2B Chem
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CatalogNumber
AH20892
ChemicalName
2-(4-Bromobenzyl)propanoic acid
CasNumber
66735-01-1
MolecularFormula
C10H11BrO2
MolecularWeight
243.0971
MdlNumber
MFCD12152839
Smiles
CC(C(=O)O)Cc1ccc(cc1)Br
Complexity
174
Covalently-bondedUnitCount
1
HeavyAtomCount
13
HydrogenBondAcceptorCount
2
HydrogenBondDonorCount
1
RotatableBondCount
3
UndefinedAtomStereocenterCount
1
Xlogp3
2.9
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CatalogNumber: AH20892
ChemicalName: 2-(4-Bromobenzyl)propanoic acid
CasNumber: 66735-01-1
MolecularFormula: C10H11BrO2
MolecularWeight: 243.0971
MdlNumber: MFCD12152839
Smiles: CC(C(=O)O)Cc1ccc(cc1)Br
Complexity: 174
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 1
RotatableBondCount: 3
UndefinedAtomStereocenterCount: 1
Xlogp3: 2.9
CatalogNumber:
AH20892
ChemicalName:
2-(4-Bromobenzyl)propanoic acid
CasNumber:
66735-01-1
MolecularFormula:
C10H11BrO2
MolecularWeight:
243.0971
MdlNumber:
MFCD12152839
Smiles:
CC(C(=O)O)Cc1ccc(cc1)Br
Complexity:
174
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
1
RotatableBondCount:
3
UndefinedAtomStereocenterCount:
1
Xlogp3:
2.9
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
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Smiles: Nc1c[nH]nc1C#N
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
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Smiles:
Nc1c[nH]nc1C#N
Complexity:
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HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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Smiles: CCNCC1CCCN1C
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Smiles:
CCNCC1CCCN1C
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HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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Smiles: Oc1ccc2c(c1)CNCC2.Cl
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
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RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
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__
ChemicalName:
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CasNumber:
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MolecularFormula:
__
MolecularWeight:
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MdlNumber:
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Smiles:
Oc1ccc2c(c1)CNCC2.Cl
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__