AA36182
1261855-01-9 | 2-Chloro-4-(3-trifluoromethoxyphenyl)benzoic acid
Manufacturer: A2B Chem
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CatalogNumber
AA36182
ChemicalName
2-Chloro-4-(3-trifluoromethoxyphenyl)benzoic acid
CasNumber
1261855-01-9
MolecularFormula
C14H8ClF3O3
MolecularWeight
316.6597
MdlNumber
MFCD18322417
Smiles
OC(=O)c1ccc(cc1Cl)c1cccc(c1)OC(F)(F)F
Complexity
375
Covalently-bondedUnitCount
1
HeavyAtomCount
21
HydrogenBondAcceptorCount
6
HydrogenBondDonorCount
1
RotatableBondCount
3
Xlogp3
4.9
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CatalogNumber: AA36182
ChemicalName: 2-Chloro-4-(3-trifluoromethoxyphenyl)benzoic acid
CasNumber: 1261855-01-9
MolecularFormula: C14H8ClF3O3
MolecularWeight: 316.6597
MdlNumber: MFCD18322417
Smiles: OC(=O)c1ccc(cc1Cl)c1cccc(c1)OC(F)(F)F
Complexity: 375
Covalently-bondedUnitCount: 1
HeavyAtomCount: 21
HydrogenBondAcceptorCount: 6
HydrogenBondDonorCount: 1
RotatableBondCount: 3
Xlogp3: 4.9
CatalogNumber:
AA36182
ChemicalName:
2-Chloro-4-(3-trifluoromethoxyphenyl)benzoic acid
CasNumber:
1261855-01-9
MolecularFormula:
C14H8ClF3O3
MolecularWeight:
316.6597
MdlNumber:
MFCD18322417
Smiles:
OC(=O)c1ccc(cc1Cl)c1cccc(c1)OC(F)(F)F
Complexity:
375
Covalently-bondedUnitCount:
1
HeavyAtomCount:
21
HydrogenBondAcceptorCount:
6
HydrogenBondDonorCount:
1
RotatableBondCount:
3
Xlogp3:
4.9
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Smiles: OC(=O)Cc1ccc(cc1[N+](=O)[O-])I
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
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RotatableBondCount: __
Xlogp3: __
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Smiles:
OC(=O)Cc1ccc(cc1[N+](=O)[O-])I
Complexity:
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
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Smiles: NCc1cc(O)cc(c1)[N+](=O)[O-]
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Smiles:
NCc1cc(O)cc(c1)[N+](=O)[O-]
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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Smiles: BrCc1cccc(c1C)O
Complexity: __
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HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
BrCc1cccc(c1C)O
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__