AH58648
80854-22-4 | 2-(3,4-Dichlorophenyl)-2-methylpropanoic acid
Manufacturer: A2B Chem
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CatalogNumber
AH58648
ChemicalName
2-(3,4-Dichlorophenyl)-2-methylpropanoic acid
CasNumber
80854-22-4
MolecularFormula
C10H10Cl2O2
MolecularWeight
233.0912
MdlNumber
MFCD11036926
Smiles
OC(=O)C(c1ccc(c(c1)Cl)Cl)(C)C
Complexity
228
Covalently-bondedUnitCount
1
HeavyAtomCount
14
HydrogenBondAcceptorCount
2
HydrogenBondDonorCount
1
RotatableBondCount
2
Xlogp3
3.6
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CatalogNumber: AH58648
ChemicalName: 2-(3,4-Dichlorophenyl)-2-methylpropanoic acid
CasNumber: 80854-22-4
MolecularFormula: C10H10Cl2O2
MolecularWeight: 233.0912
MdlNumber: MFCD11036926
Smiles: OC(=O)C(c1ccc(c(c1)Cl)Cl)(C)C
Complexity: 228
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 3.6
CatalogNumber:
AH58648
ChemicalName:
2-(3,4-Dichlorophenyl)-2-methylpropanoic acid
CasNumber:
80854-22-4
MolecularFormula:
C10H10Cl2O2
MolecularWeight:
233.0912
MdlNumber:
MFCD11036926
Smiles:
OC(=O)C(c1ccc(c(c1)Cl)Cl)(C)C
Complexity:
228
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
3.6
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MolecularFormula: __
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Smiles: Nc1csc(n1)N1CCCCC1
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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Smiles:
Nc1csc(n1)N1CCCCC1
Complexity:
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RotatableBondCount:
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Smiles: N#Cc1cnn(c1Br)c1ccccc1
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Smiles:
N#Cc1cnn(c1Br)c1ccccc1
Complexity:
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Covalently-bondedUnitCount:
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
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RotatableBondCount:
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Xlogp3:
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Smiles: C[N+](C1CCC(CC1)CC1CCC(CC1)[N+](C)(C)C)(C)C.[I-].[I-]
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
C[N+](C1CCC(CC1)CC1CCC(CC1)[N+](C)(C)C)(C)C.[I-].[I-]
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__