AA91803
1735-91-7 | 2-(2-Nitro-4-trifluoromethylphenyl)acetic acid
Manufacturer: A2B Chem
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CatalogNumber
AA91803
ChemicalName
2-(2-Nitro-4-trifluoromethylphenyl)acetic acid
CasNumber
1735-91-7
MolecularFormula
C9H6F3NO4
MolecularWeight
249.1434
MdlNumber
MFCD00091534
Smiles
OC(=O)Cc1ccc(cc1[N+](=O)[O-])C(F)(F)F
Complexity
312
Covalently-bondedUnitCount
1
HeavyAtomCount
17
HydrogenBondAcceptorCount
7
HydrogenBondDonorCount
1
RotatableBondCount
2
Xlogp3
2.1
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CatalogNumber: AA91803
ChemicalName: 2-(2-Nitro-4-trifluoromethylphenyl)acetic acid
CasNumber: 1735-91-7
MolecularFormula: C9H6F3NO4
MolecularWeight: 249.1434
MdlNumber: MFCD00091534
Smiles: OC(=O)Cc1ccc(cc1[N+](=O)[O-])C(F)(F)F
Complexity: 312
Covalently-bondedUnitCount: 1
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 7
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 2.1
CatalogNumber:
AA91803
ChemicalName:
2-(2-Nitro-4-trifluoromethylphenyl)acetic acid
CasNumber:
1735-91-7
MolecularFormula:
C9H6F3NO4
MolecularWeight:
249.1434
MdlNumber:
MFCD00091534
Smiles:
OC(=O)Cc1ccc(cc1[N+](=O)[O-])C(F)(F)F
Complexity:
312
Covalently-bondedUnitCount:
1
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
7
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
2.1
CatalogNumber: AA91804
ChemicalName: 6-Trifluoromethyloxindole
CasNumber: 1735-89-3
MolecularFormula: C9H6F3NO
MolecularWeight: 201.1452
MdlNumber: MFCD01075220
Smiles: O=C1Cc2c(N1)cc(cc2)C(F)(F)F
Complexity: 251
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: __
Xlogp3: 2
CatalogNumber:
AA91804
ChemicalName:
6-Trifluoromethyloxindole
CasNumber:
1735-89-3
MolecularFormula:
C9H6F3NO
MolecularWeight:
201.1452
MdlNumber:
MFCD01075220
Smiles:
O=C1Cc2c(N1)cc(cc2)C(F)(F)F
Complexity:
251
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
__
Xlogp3:
2
CatalogNumber: AA91805
ChemicalName: 2-Cyano-n-(4-fluorophenyl)acetamide
CasNumber: 1735-88-2
MolecularFormula: C9H7FN2O
MolecularWeight: 178.1631
MdlNumber: MFCD00276110
Smiles: N#CCC(=O)Nc1ccc(cc1)F
Complexity: 225
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 1.9
CatalogNumber:
AA91805
ChemicalName:
2-Cyano-n-(4-fluorophenyl)acetamide
CasNumber:
1735-88-2
MolecularFormula:
C9H7FN2O
MolecularWeight:
178.1631
MdlNumber:
MFCD00276110
Smiles:
N#CCC(=O)Nc1ccc(cc1)F
Complexity:
225
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
1.9
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: FC(=O)C(C(F)(F)F)(C(F)(F)F)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
FC(=O)C(C(F)(F)F)(C(F)(F)F)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__