AI41536
1845693-81-3 | 2-Bromo-4-fluoro-N-methyl-6-nitroaniline
Manufacturer: A2B Chem
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CatalogNumber
AI41536
ChemicalName
2-Bromo-4-fluoro-N-methyl-6-nitroaniline
CasNumber
1845693-81-3
MolecularFormula
C7H6BrFN2O2
MolecularWeight
249.0371
MdlNumber
MFCD28962791
Smiles
CNc1c(Br)cc(cc1[N+](=O)[O-])F
Complexity
199
Covalently-bondedUnitCount
1
HeavyAtomCount
13
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
1
RotatableBondCount
1
Xlogp3
3.1
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CatalogNumber: AI41536
ChemicalName: 2-Bromo-4-fluoro-N-methyl-6-nitroaniline
CasNumber: 1845693-81-3
MolecularFormula: C7H6BrFN2O2
MolecularWeight: 249.0371
MdlNumber: MFCD28962791
Smiles: CNc1c(Br)cc(cc1[N+](=O)[O-])F
Complexity: 199
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 3.1
CatalogNumber:
AI41536
ChemicalName:
2-Bromo-4-fluoro-N-methyl-6-nitroaniline
CasNumber:
1845693-81-3
MolecularFormula:
C7H6BrFN2O2
MolecularWeight:
249.0371
MdlNumber:
MFCD28962791
Smiles:
CNc1c(Br)cc(cc1[N+](=O)[O-])F
Complexity:
199
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
3.1
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: NC(=O)Cc1cccc(c1)N.Cl
Complexity: 147
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
NC(=O)Cc1cccc(c1)N.Cl
Complexity:
147
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Nc1ccc(c(c1)C(F)(F)F)C.Cl
Complexity: 155
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Nc1ccc(c(c1)C(F)(F)F)C.Cl
Complexity:
155
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AI41539
ChemicalName: 2-Amino-3-chloro-4-methylphenol hydrochloride
CasNumber: 1845696-03-8
MolecularFormula: C7H9Cl2NO
MolecularWeight: 194.0585
MdlNumber: MFCD28515389
Smiles: Oc1ccc(c(c1N)Cl)C.Cl
Complexity: 120
Covalently-bondedUnitCount: 2
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 3
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
AI41539
ChemicalName:
2-Amino-3-chloro-4-methylphenol hydrochloride
CasNumber:
1845696-03-8
MolecularFormula:
C7H9Cl2NO
MolecularWeight:
194.0585
MdlNumber:
MFCD28515389
Smiles:
Oc1ccc(c(c1N)Cl)C.Cl
Complexity:
120
Covalently-bondedUnitCount:
2
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
3
RotatableBondCount:
__
Xlogp3:
__