AG70948
64798-35-2 | 2-(3-Chlorophenyl)-2-methylpropanoic acid
Manufacturer: A2B Chem
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CatalogNumber
AG70948
ChemicalName
2-(3-Chlorophenyl)-2-methylpropanoic acid
CasNumber
64798-35-2
MolecularFormula
C10H11ClO2
MolecularWeight
198.6461
MdlNumber
MFCD11036925
Smiles
Clc1cccc(c1)C(C(=O)O)(C)C
Complexity
201
Covalently-bondedUnitCount
1
HeavyAtomCount
13
HydrogenBondAcceptorCount
2
HydrogenBondDonorCount
1
RotatableBondCount
2
Xlogp3
2.9
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CatalogNumber: AG70948
ChemicalName: 2-(3-Chlorophenyl)-2-methylpropanoic acid
CasNumber: 64798-35-2
MolecularFormula: C10H11ClO2
MolecularWeight: 198.6461
MdlNumber: MFCD11036925
Smiles: Clc1cccc(c1)C(C(=O)O)(C)C
Complexity: 201
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 2.9
CatalogNumber:
AG70948
ChemicalName:
2-(3-Chlorophenyl)-2-methylpropanoic acid
CasNumber:
64798-35-2
MolecularFormula:
C10H11ClO2
MolecularWeight:
198.6461
MdlNumber:
MFCD11036925
Smiles:
Clc1cccc(c1)C(C(=O)O)(C)C
Complexity:
201
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
2.9
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Smiles: OCc1cccc(c1)CN1CCN(CC1)C
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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Smiles:
OCc1cccc(c1)CN1CCN(CC1)C
Complexity:
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Smiles: OCC(C(C(C(C=O)O)O)OC(C(C(C(C(CO)O)O)O)O)O)O
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Smiles:
OCC(C(C(C(C=O)O)O)OC(C(C(C(C(CO)O)O)O)O)O)O
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Smiles: CCOC(=O)/C(=N/Nc1ccccc1C)/Cl
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ChemicalName:
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CasNumber:
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MolecularFormula:
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MolecularWeight:
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MdlNumber:
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Smiles:
CCOC(=O)/C(=N/Nc1ccccc1C)/Cl
Complexity:
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Covalently-bondedUnitCount:
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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Xlogp3:
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