AA41376
131395-29-4 | 2-Bromo-4-(trifluoromethoxy)acetanilide
Manufacturer: A2B Chem
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CatalogNumber
AA41376
ChemicalName
2-Bromo-4-(trifluoromethoxy)acetanilide
CasNumber
131395-29-4
MolecularFormula
C9H7BrF3NO2
MolecularWeight
298.0566
MdlNumber
MFCD00126677
Smiles
CC(=O)Nc1ccc(cc1Br)OC(F)(F)F
Complexity
260
Covalently-bondedUnitCount
1
HeavyAtomCount
16
HydrogenBondAcceptorCount
5
HydrogenBondDonorCount
1
RotatableBondCount
2
Xlogp3
3.2
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CatalogNumber: AA41376
ChemicalName: 2-Bromo-4-(trifluoromethoxy)acetanilide
CasNumber: 131395-29-4
MolecularFormula: C9H7BrF3NO2
MolecularWeight: 298.0566
MdlNumber: MFCD00126677
Smiles: CC(=O)Nc1ccc(cc1Br)OC(F)(F)F
Complexity: 260
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 3.2
CatalogNumber:
AA41376
ChemicalName:
2-Bromo-4-(trifluoromethoxy)acetanilide
CasNumber:
131395-29-4
MolecularFormula:
C9H7BrF3NO2
MolecularWeight:
298.0566
MdlNumber:
MFCD00126677
Smiles:
CC(=O)Nc1ccc(cc1Br)OC(F)(F)F
Complexity:
260
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
3.2
CatalogNumber: AA41377
ChemicalName: 4-(2,2,2-Trifluoroethyl)aniline
CasNumber: 131395-17-0
MolecularFormula: C8H8F3N
MolecularWeight: 175.151
MdlNumber: MFCD04972985
Smiles: FC(Cc1ccc(cc1)N)(F)F
Complexity: 136
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 2.5
CatalogNumber:
AA41377
ChemicalName:
4-(2,2,2-Trifluoroethyl)aniline
CasNumber:
131395-17-0
MolecularFormula:
C8H8F3N
MolecularWeight:
175.151
MdlNumber:
MFCD04972985
Smiles:
FC(Cc1ccc(cc1)N)(F)F
Complexity:
136
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
2.5
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Smiles: Nc1nc2c(s1)cc(cc2)C(C)(C)C
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Nc1nc2c(s1)cc(cc2)C(C)(C)C
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Smiles: CC(=O)Cn1nnc(n1)[N+](=O)[O-]
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Smiles:
CC(=O)Cn1nnc(n1)[N+](=O)[O-]
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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