AI41929
1864060-72-9 | N-(2-Fluorophenyl)-4-nitro-N-(4-nitrophenyl)aniline
Manufacturer: A2B Chem
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CatalogNumber
AI41929
ChemicalName
N-(2-Fluorophenyl)-4-nitro-N-(4-nitrophenyl)aniline
CasNumber
1864060-72-9
MolecularFormula
C18H12FN3O4
MolecularWeight
353.304
MdlNumber
MFCD29035376
Smiles
Fc1ccccc1N(c1ccc(cc1)[N+](=O)[O-])c1ccc(cc1)[N+](=O)[O-]
Complexity
460
Covalently-bondedUnitCount
1
HeavyAtomCount
26
HydrogenBondAcceptorCount
6
RotatableBondCount
3
Xlogp3
4.9
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CatalogNumber: AI41929
ChemicalName: N-(2-Fluorophenyl)-4-nitro-N-(4-nitrophenyl)aniline
CasNumber: 1864060-72-9
MolecularFormula: C18H12FN3O4
MolecularWeight: 353.304
MdlNumber: MFCD29035376
Smiles: Fc1ccccc1N(c1ccc(cc1)[N+](=O)[O-])c1ccc(cc1)[N+](=O)[O-]
Complexity: 460
Covalently-bondedUnitCount: 1
HeavyAtomCount: 26
HydrogenBondAcceptorCount: 6
RotatableBondCount: 3
Xlogp3: 4.9
CatalogNumber:
AI41929
ChemicalName:
N-(2-Fluorophenyl)-4-nitro-N-(4-nitrophenyl)aniline
CasNumber:
1864060-72-9
MolecularFormula:
C18H12FN3O4
MolecularWeight:
353.304
MdlNumber:
MFCD29035376
Smiles:
Fc1ccccc1N(c1ccc(cc1)[N+](=O)[O-])c1ccc(cc1)[N+](=O)[O-]
Complexity:
460
Covalently-bondedUnitCount:
1
HeavyAtomCount:
26
HydrogenBondAcceptorCount:
6
RotatableBondCount:
3
Xlogp3:
4.9
CatalogNumber: AI41930
ChemicalName: tert-Butyl 5-(trifluoroacetyl)thiophene-2-carboxylate
CasNumber: 1864060-79-6
MolecularFormula: C11H11F3O3S
MolecularWeight: 280.2634
MdlNumber: MFCD29035390
Smiles: O=C(c1ccc(s1)C(=O)C(F)(F)F)OC(C)(C)C
Complexity: 346
Covalently-bondedUnitCount: 1
HeavyAtomCount: 18
HydrogenBondAcceptorCount: 7
RotatableBondCount: 4
Xlogp3: 3.9
CatalogNumber:
AI41930
ChemicalName:
tert-Butyl 5-(trifluoroacetyl)thiophene-2-carboxylate
CasNumber:
1864060-79-6
MolecularFormula:
C11H11F3O3S
MolecularWeight:
280.2634
MdlNumber:
MFCD29035390
Smiles:
O=C(c1ccc(s1)C(=O)C(F)(F)F)OC(C)(C)C
Complexity:
346
Covalently-bondedUnitCount:
1
HeavyAtomCount:
18
HydrogenBondAcceptorCount:
7
RotatableBondCount:
4
Xlogp3:
3.9
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COc1ccc(cc1)CNC(=O)CC=C
Complexity: 208
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: 1.8
CatalogNumber:
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CasNumber:
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MolecularFormula:
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MolecularWeight:
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Smiles:
COc1ccc(cc1)CNC(=O)CC=C
Complexity:
208
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
1.8
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Smiles: CCOC(=O)C1CNCCS1.Cl
Complexity: __
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Xlogp3: __
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CasNumber:
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MolecularFormula:
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MolecularWeight:
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Smiles:
CCOC(=O)C1CNCCS1.Cl
Complexity:
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Covalently-bondedUnitCount:
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
__
RotatableBondCount:
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Xlogp3:
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