AA49028
1365272-19-0 | 2-Fluoro-4-(2-nitrophenyl)benzoic acid
Manufacturer: A2B Chem
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CatalogNumber
AA49028
ChemicalName
2-Fluoro-4-(2-nitrophenyl)benzoic acid
CasNumber
1365272-19-0
MolecularFormula
C13H8FNO4
MolecularWeight
261.2053
MdlNumber
MFCD21609593
Smiles
[O-][N+](=O)c1ccccc1c1ccc(c(c1)F)C(=O)O
Complexity
357
Covalently-bondedUnitCount
1
HeavyAtomCount
19
HydrogenBondAcceptorCount
5
HydrogenBondDonorCount
1
RotatableBondCount
2
Xlogp3
3
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CatalogNumber: AA49028
ChemicalName: 2-Fluoro-4-(2-nitrophenyl)benzoic acid
CasNumber: 1365272-19-0
MolecularFormula: C13H8FNO4
MolecularWeight: 261.2053
MdlNumber: MFCD21609593
Smiles: [O-][N+](=O)c1ccccc1c1ccc(c(c1)F)C(=O)O
Complexity: 357
Covalently-bondedUnitCount: 1
HeavyAtomCount: 19
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 3
CatalogNumber:
AA49028
ChemicalName:
2-Fluoro-4-(2-nitrophenyl)benzoic acid
CasNumber:
1365272-19-0
MolecularFormula:
C13H8FNO4
MolecularWeight:
261.2053
MdlNumber:
MFCD21609593
Smiles:
[O-][N+](=O)c1ccccc1c1ccc(c(c1)F)C(=O)O
Complexity:
357
Covalently-bondedUnitCount:
1
HeavyAtomCount:
19
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
3
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCOc1c(Cl)cc(cc1[N+](=O)[O-])Br
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
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:
CCOc1c(Cl)cc(cc1[N+](=O)[O-])Br
Complexity:
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Covalently-bondedUnitCount:
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCCNC(=O)c1ccc(c2c1cccc2)Br
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
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Xlogp3: __
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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:
CCCNC(=O)c1ccc(c2c1cccc2)Br
Complexity:
__
Covalently-bondedUnitCount:
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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Xlogp3:
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CatalogNumber: AA49031
ChemicalName: 5-Bromo-2-(N-cyclohexylamino)-3,4-difluoroaniline
CasNumber: 1365272-15-6
MolecularFormula: C12H15BrF2N2
MolecularWeight: 305.1617
MdlNumber: MFCD21609499
Smiles: Nc1cc(Br)c(c(c1NC1CCCCC1)F)F
Complexity: 249
Covalently-bondedUnitCount: 1
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 2
RotatableBondCount: 2
Xlogp3: 3.9
CatalogNumber:
AA49031
ChemicalName:
5-Bromo-2-(N-cyclohexylamino)-3,4-difluoroaniline
CasNumber:
1365272-15-6
MolecularFormula:
C12H15BrF2N2
MolecularWeight:
305.1617
MdlNumber:
MFCD21609499
Smiles:
Nc1cc(Br)c(c(c1NC1CCCCC1)F)F
Complexity:
249
Covalently-bondedUnitCount:
1
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
2
RotatableBondCount:
2
Xlogp3:
3.9