AH90596
886498-12-0 | 3-(3-Chloro-2-fluorophenyl)propanoic acid
Manufacturer: A2B Chem
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CatalogNumber
AH90596
ChemicalName
3-(3-Chloro-2-fluorophenyl)propanoic acid
CasNumber
886498-12-0
MolecularFormula
C9H8ClFO2
MolecularWeight
202.61
MdlNumber
MFCD04115206
Smiles
OC(=O)CCc1cccc(c1F)Cl
Complexity
187
Covalently-bondedUnitCount
1
HeavyAtomCount
13
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
3
Xlogp3
2.4
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CatalogNumber: AH90596
ChemicalName: 3-(3-Chloro-2-fluorophenyl)propanoic acid
CasNumber: 886498-12-0
MolecularFormula: C9H8ClFO2
MolecularWeight: 202.61
MdlNumber: MFCD04115206
Smiles: OC(=O)CCc1cccc(c1F)Cl
Complexity: 187
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 3
Xlogp3: 2.4
CatalogNumber:
AH90596
ChemicalName:
3-(3-Chloro-2-fluorophenyl)propanoic acid
CasNumber:
886498-12-0
MolecularFormula:
C9H8ClFO2
MolecularWeight:
202.61
MdlNumber:
MFCD04115206
Smiles:
OC(=O)CCc1cccc(c1F)Cl
Complexity:
187
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
3
Xlogp3:
2.4
CatalogNumber: __
ChemicalName: __
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MolecularFormula: __
MolecularWeight: __
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Smiles: COc1cc(ccc1CC(=O)O)OC(F)(F)F
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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__
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Smiles:
COc1cc(ccc1CC(=O)O)OC(F)(F)F
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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MolecularFormula: __
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Smiles: Clc1cc(cc(c1)C(=O)C)OC(F)(F)F
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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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:
Clc1cc(cc(c1)C(=O)C)OC(F)(F)F
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
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Xlogp3:
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ChemicalName: __
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MolecularFormula: __
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Smiles: Fc1cc(ccc1OC(F)(F)F)C(=O)Cl
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Fc1cc(ccc1OC(F)(F)F)C(=O)Cl
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__