AB97587
886499-21-4 | 2-Bromo-6-nitro-4-trifluoromethoxyaniline
Manufacturer: A2B Chem
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CatalogNumber
AB97587
ChemicalName
2-Bromo-6-nitro-4-trifluoromethoxyaniline
CasNumber
886499-21-4
MolecularFormula
C7H4BrF3N2O3
MolecularWeight
301.0175
MdlNumber
MFCD04039212
Smiles
[O-][N+](=O)c1cc(cc(c1N)Br)OC(F)(F)F
Complexity
271
Covalently-bondedUnitCount
1
HeavyAtomCount
16
HydrogenBondAcceptorCount
7
HydrogenBondDonorCount
1
RotatableBondCount
1
Xlogp3
3.5
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CatalogNumber: AB97587
ChemicalName: 2-Bromo-6-nitro-4-trifluoromethoxyaniline
CasNumber: 886499-21-4
MolecularFormula: C7H4BrF3N2O3
MolecularWeight: 301.0175
MdlNumber: MFCD04039212
Smiles: [O-][N+](=O)c1cc(cc(c1N)Br)OC(F)(F)F
Complexity: 271
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 7
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 3.5
CatalogNumber:
AB97587
ChemicalName:
2-Bromo-6-nitro-4-trifluoromethoxyaniline
CasNumber:
886499-21-4
MolecularFormula:
C7H4BrF3N2O3
MolecularWeight:
301.0175
MdlNumber:
MFCD04039212
Smiles:
[O-][N+](=O)c1cc(cc(c1N)Br)OC(F)(F)F
Complexity:
271
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
7
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
3.5
CatalogNumber: __
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Smiles: Clc1cccc(c1)c1n[nH]c(=O)cc1Cl
Complexity: __
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Smiles:
Clc1cccc(c1)c1n[nH]c(=O)cc1Cl
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CatalogNumber: AB97594
ChemicalName: Methyl 4-amino-2,3-difluorobenzoate
CasNumber: 886497-08-1
MolecularFormula: C8H7F2NO2
MolecularWeight: 187.1435
MdlNumber: MFCD06201867
Smiles: COC(=O)c1ccc(c(c1F)F)N
Complexity: 201
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 1.3
CatalogNumber:
AB97594
ChemicalName:
Methyl 4-amino-2,3-difluorobenzoate
CasNumber:
886497-08-1
MolecularFormula:
C8H7F2NO2
MolecularWeight:
187.1435
MdlNumber:
MFCD06201867
Smiles:
COC(=O)c1ccc(c(c1F)F)N
Complexity:
201
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
1.3