AE62676
1414029-51-8 | N,N-Dimethyl 4-bromo-3-nitrobenzylamine
Manufacturer: A2B Chem
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CatalogNumber
AE62676
ChemicalName
N,N-Dimethyl 4-bromo-3-nitrobenzylamine
CasNumber
1414029-51-8
MolecularFormula
C9H11BrN2O2
MolecularWeight
259.0998
MdlNumber
MFCD22574936
Smiles
CN(Cc1ccc(c(c1)[N+](=O)[O-])Br)C
Complexity
206
Covalently-bondedUnitCount
1
HeavyAtomCount
14
HydrogenBondAcceptorCount
3
RotatableBondCount
2
Xlogp3
2.3
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CatalogNumber: AE62676
ChemicalName: N,N-Dimethyl 4-bromo-3-nitrobenzylamine
CasNumber: 1414029-51-8
MolecularFormula: C9H11BrN2O2
MolecularWeight: 259.0998
MdlNumber: MFCD22574936
Smiles: CN(Cc1ccc(c(c1)[N+](=O)[O-])Br)C
Complexity: 206
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 3
RotatableBondCount: 2
Xlogp3: 2.3
CatalogNumber:
AE62676
ChemicalName:
N,N-Dimethyl 4-bromo-3-nitrobenzylamine
CasNumber:
1414029-51-8
MolecularFormula:
C9H11BrN2O2
MolecularWeight:
259.0998
MdlNumber:
MFCD22574936
Smiles:
CN(Cc1ccc(c(c1)[N+](=O)[O-])Br)C
Complexity:
206
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
3
RotatableBondCount:
2
Xlogp3:
2.3
CatalogNumber: AE62677
ChemicalName: Methyl 2-[4-(trifluoromethyl)phenyl]acetate
CasNumber: 135325-18-7
MolecularFormula: C10H9F3O2
MolecularWeight: 218.17246960000006
MdlNumber: MFCD08669944
Smiles: COC(=O)Cc1ccc(cc1)C(F)(F)F
Complexity: 217
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 5
RotatableBondCount: 3
Xlogp3: 2.8
CatalogNumber:
AE62677
ChemicalName:
Methyl 2-[4-(trifluoromethyl)phenyl]acetate
CasNumber:
135325-18-7
MolecularFormula:
C10H9F3O2
MolecularWeight:
218.17246960000006
MdlNumber:
MFCD08669944
Smiles:
COC(=O)Cc1ccc(cc1)C(F)(F)F
Complexity:
217
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
5
RotatableBondCount:
3
Xlogp3:
2.8
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CC(C(=O)N1CCOCC1)N
Complexity: 143
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: -1.2
CatalogNumber:
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CasNumber:
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MolecularFormula:
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MolecularWeight:
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MdlNumber:
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Smiles:
CC(C(=O)N1CCOCC1)N
Complexity:
143
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
-1.2
CatalogNumber: __
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MolecularFormula: __
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Smiles: CCN(C(=O)C(c1ccccc1)NC(=O)OCc1ccccc1)CC
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
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MolecularFormula:
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MolecularWeight:
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MdlNumber:
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Smiles:
CCN(C(=O)C(c1ccccc1)NC(=O)OCc1ccccc1)CC
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__