AA51995
13311-84-7 | 2-methyl-N-[4-nitro-3-(trifluoromethyl)phenyl]propanamide
Manufacturer: A2B Chem
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CatalogNumber
AA51995
ChemicalName
2-methyl-N-[4-nitro-3-(trifluoromethyl)phenyl]propanamide
CasNumber
13311-84-7
MolecularFormula
C11H11F3N2O3
MolecularWeight
276.2118
MdlNumber
MFCD00072009
Smiles
O=C(C(C)C)Nc1ccc(c(c1)C(F)(F)F)[N+](=O)[O-]
Complexity
352
Covalently-bondedUnitCount
1
HeavyAtomCount
19
HydrogenBondAcceptorCount
6
HydrogenBondDonorCount
1
RotatableBondCount
2
Xlogp3
3.3
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CatalogNumber: AA51995
ChemicalName: 2-methyl-N-[4-nitro-3-(trifluoromethyl)phenyl]propanamide
CasNumber: 13311-84-7
MolecularFormula: C11H11F3N2O3
MolecularWeight: 276.2118
MdlNumber: MFCD00072009
Smiles: O=C(C(C)C)Nc1ccc(c(c1)C(F)(F)F)[N+](=O)[O-]
Complexity: 352
Covalently-bondedUnitCount: 1
HeavyAtomCount: 19
HydrogenBondAcceptorCount: 6
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 3.3
CatalogNumber:
AA51995
ChemicalName:
2-methyl-N-[4-nitro-3-(trifluoromethyl)phenyl]propanamide
CasNumber:
13311-84-7
MolecularFormula:
C11H11F3N2O3
MolecularWeight:
276.2118
MdlNumber:
MFCD00072009
Smiles:
O=C(C(C)C)Nc1ccc(c(c1)C(F)(F)F)[N+](=O)[O-]
Complexity:
352
Covalently-bondedUnitCount:
1
HeavyAtomCount:
19
HydrogenBondAcceptorCount:
6
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
3.3
CatalogNumber: __
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MolecularFormula: __
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Smiles: COc1ccc2c(c1)NCCN2
Complexity: __
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Xlogp3: __
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Smiles:
COc1ccc2c(c1)NCCN2
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Smiles: CC1Nc2ccccc2NC1C
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Smiles:
CC1Nc2ccccc2NC1C
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Smiles: Clc1cc(Br)c(c(c1O)Cl)Cl
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MolecularFormula:
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Smiles:
Clc1cc(Br)c(c(c1O)Cl)Cl
Complexity:
__
Covalently-bondedUnitCount:
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
__
RotatableBondCount:
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Xlogp3:
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