AF60971
397-28-4 | 4-[3-(Trifluoromethyl)phenyl]aniline
Manufacturer: A2B Chem
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CatalogNumber
AF60971
ChemicalName
4-[3-(Trifluoromethyl)phenyl]aniline
CasNumber
397-28-4
MolecularFormula
C13H10F3N
MolecularWeight
237.2204
MdlNumber
MFCD00167499
Smiles
Nc1ccc(cc1)c1cccc(c1)C(F)(F)F
Complexity
244
Covalently-bondedUnitCount
1
HeavyAtomCount
17
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
1
RotatableBondCount
1
Xlogp3
3.7
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CatalogNumber: AF60971
ChemicalName: 4-[3-(Trifluoromethyl)phenyl]aniline
CasNumber: 397-28-4
MolecularFormula: C13H10F3N
MolecularWeight: 237.2204
MdlNumber: MFCD00167499
Smiles: Nc1ccc(cc1)c1cccc(c1)C(F)(F)F
Complexity: 244
Covalently-bondedUnitCount: 1
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 3.7
CatalogNumber:
AF60971
ChemicalName:
4-[3-(Trifluoromethyl)phenyl]aniline
CasNumber:
397-28-4
MolecularFormula:
C13H10F3N
MolecularWeight:
237.2204
MdlNumber:
MFCD00167499
Smiles:
Nc1ccc(cc1)c1cccc(c1)C(F)(F)F
Complexity:
244
Covalently-bondedUnitCount:
1
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
3.7
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Smiles: COc1cccc(c1)c1ccccc1N
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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Smiles:
COc1cccc(c1)c1ccccc1N
Complexity:
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Covalently-bondedUnitCount:
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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Smiles: O=C1C=CC(=O)N1c1cccc(c1C)C
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
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__
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CasNumber:
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MolecularFormula:
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MolecularWeight:
__
MdlNumber:
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Smiles:
O=C1C=CC(=O)N1c1cccc(c1C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
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MolecularFormula: __
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Smiles: O=Cc1ccc(c(c1)COc1ccccc1[N+](=O)[O-])OC
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=Cc1ccc(c(c1)COc1ccccc1[N+](=O)[O-])OC
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__