AB49478
393-15-7 | 4-Methoxy-3-(trifluoromethyl)aniline
Manufacturer: A2B Chem
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CatalogNumber
AB49478
ChemicalName
4-Methoxy-3-(trifluoromethyl)aniline
CasNumber
393-15-7
MolecularFormula
C8H8F3NO
MolecularWeight
191.1504
MdlNumber
MFCD00043460
Smiles
COc1ccc(cc1C(F)(F)F)N
Complexity
171
Covalently-bondedUnitCount
1
HeavyAtomCount
13
HydrogenBondAcceptorCount
5
HydrogenBondDonorCount
1
RotatableBondCount
1
Xlogp3
2.1
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CatalogNumber: AB49478
ChemicalName: 4-Methoxy-3-(trifluoromethyl)aniline
CasNumber: 393-15-7
MolecularFormula: C8H8F3NO
MolecularWeight: 191.1504
MdlNumber: MFCD00043460
Smiles: COc1ccc(cc1C(F)(F)F)N
Complexity: 171
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 2.1
CatalogNumber:
AB49478
ChemicalName:
4-Methoxy-3-(trifluoromethyl)aniline
CasNumber:
393-15-7
MolecularFormula:
C8H8F3NO
MolecularWeight:
191.1504
MdlNumber:
MFCD00043460
Smiles:
COc1ccc(cc1C(F)(F)F)N
Complexity:
171
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
2.1
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: NCc1ccno1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
NCc1ccno1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AB49480
ChemicalName: (1,3-Dimethyl-1H-pyrazol-4-yl)methanamine
CasNumber: 400756-28-7
MolecularFormula: C6H11N3
MolecularWeight: 125.1716
MdlNumber: MFCD02055709
Smiles: NCc1cn(nc1C)C
Complexity: 94.3
Covalently-bondedUnitCount: 1
HeavyAtomCount: 9
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: -0.5
CatalogNumber:
AB49480
ChemicalName:
(1,3-Dimethyl-1H-pyrazol-4-yl)methanamine
CasNumber:
400756-28-7
MolecularFormula:
C6H11N3
MolecularWeight:
125.1716
MdlNumber:
MFCD02055709
Smiles:
NCc1cn(nc1C)C
Complexity:
94.3
Covalently-bondedUnitCount:
1
HeavyAtomCount:
9
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
-0.5
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCOC(=O)c1cc2c([nH]1)cncc2
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCOC(=O)c1cc2c([nH]1)cncc2
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__