AD25472
1352318-56-9 | 4-(3-Fluoro-4-methylphenyl)benzonitrile
Manufacturer: A2B Chem
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CatalogNumber
AD25472
ChemicalName
4-(3-Fluoro-4-methylphenyl)benzonitrile
CasNumber
1352318-56-9
MolecularFormula
C14H10FN
MolecularWeight
211.2343
MdlNumber
MFCD20529469
Smiles
N#Cc1ccc(cc1)c1ccc(c(c1)F)C
Complexity
272
Covalently-bondedUnitCount
1
HeavyAtomCount
16
HydrogenBondAcceptorCount
2
RotatableBondCount
1
Xlogp3
3.7
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CatalogNumber: AD25472
ChemicalName: 4-(3-Fluoro-4-methylphenyl)benzonitrile
CasNumber: 1352318-56-9
MolecularFormula: C14H10FN
MolecularWeight: 211.2343
MdlNumber: MFCD20529469
Smiles: N#Cc1ccc(cc1)c1ccc(c(c1)F)C
Complexity: 272
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 2
RotatableBondCount: 1
Xlogp3: 3.7
CatalogNumber:
AD25472
ChemicalName:
4-(3-Fluoro-4-methylphenyl)benzonitrile
CasNumber:
1352318-56-9
MolecularFormula:
C14H10FN
MolecularWeight:
211.2343
MdlNumber:
MFCD20529469
Smiles:
N#Cc1ccc(cc1)c1ccc(c(c1)F)C
Complexity:
272
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
2
RotatableBondCount:
1
Xlogp3:
3.7
CatalogNumber: AD25473
ChemicalName: N-tert-Butyl-4-nitro-2-(trifluoromethoxy)aniline
CasNumber: 1352318-51-4
MolecularFormula: C11H13F3N2O3
MolecularWeight: 278.2277
MdlNumber: MFCD20491423
Smiles: [O-][N+](=O)c1ccc(c(c1)OC(F)(F)F)NC(C)(C)C
Complexity: 323
Covalently-bondedUnitCount: 1
HeavyAtomCount: 19
HydrogenBondAcceptorCount: 7
RotatableBondCount: 3
Xlogp3: 3.9
CatalogNumber:
AD25473
ChemicalName:
N-tert-Butyl-4-nitro-2-(trifluoromethoxy)aniline
CasNumber:
1352318-51-4
MolecularFormula:
C11H13F3N2O3
MolecularWeight:
278.2277
MdlNumber:
MFCD20491423
Smiles:
[O-][N+](=O)c1ccc(c(c1)OC(F)(F)F)NC(C)(C)C
Complexity:
323
Covalently-bondedUnitCount:
1
HeavyAtomCount:
19
HydrogenBondAcceptorCount:
7
RotatableBondCount:
3
Xlogp3:
3.9
CatalogNumber: AD25474
ChemicalName: 4-(3-Chloro-4-methylphenyl)benzonitrile
CasNumber: 1352318-49-0
MolecularFormula: C14H10ClN
MolecularWeight: 227.6889
MdlNumber: MFCD20529466
Smiles: N#Cc1ccc(cc1)c1ccc(c(c1)Cl)C
Complexity: 272
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 1
RotatableBondCount: 1
Xlogp3: 4.3
CatalogNumber:
AD25474
ChemicalName:
4-(3-Chloro-4-methylphenyl)benzonitrile
CasNumber:
1352318-49-0
MolecularFormula:
C14H10ClN
MolecularWeight:
227.6889
MdlNumber:
MFCD20529466
Smiles:
N#Cc1ccc(cc1)c1ccc(c(c1)Cl)C
Complexity:
272
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
1
RotatableBondCount:
1
Xlogp3:
4.3
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Smiles: COC(=O)c1cc(F)cc(c1)c1ccccc1C#N
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Smiles:
COC(=O)c1cc(F)cc(c1)c1ccccc1C#N
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HydrogenBondAcceptorCount:
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