AE61976
123864-93-7 | 2-Fluoro-4-(4-methoxyphenyl)benzonitrile
Manufacturer: A2B Chem
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CatalogNumber
AE61976
ChemicalName
2-Fluoro-4-(4-methoxyphenyl)benzonitrile
CasNumber
123864-93-7
MolecularFormula
C14H10FNO
MolecularWeight
227.2337
MdlNumber
MFCD06797371
Smiles
COc1ccc(cc1)c1ccc(c(c1)F)C#N
Complexity
290
Covalently-bondedUnitCount
1
HeavyAtomCount
17
HydrogenBondAcceptorCount
3
RotatableBondCount
2
Xlogp3
3.3
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CatalogNumber: AE61976
ChemicalName: 2-Fluoro-4-(4-methoxyphenyl)benzonitrile
CasNumber: 123864-93-7
MolecularFormula: C14H10FNO
MolecularWeight: 227.2337
MdlNumber: MFCD06797371
Smiles: COc1ccc(cc1)c1ccc(c(c1)F)C#N
Complexity: 290
Covalently-bondedUnitCount: 1
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 3
RotatableBondCount: 2
Xlogp3: 3.3
CatalogNumber:
AE61976
ChemicalName:
2-Fluoro-4-(4-methoxyphenyl)benzonitrile
CasNumber:
123864-93-7
MolecularFormula:
C14H10FNO
MolecularWeight:
227.2337
MdlNumber:
MFCD06797371
Smiles:
COc1ccc(cc1)c1ccc(c(c1)F)C#N
Complexity:
290
Covalently-bondedUnitCount:
1
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
3
RotatableBondCount:
2
Xlogp3:
3.3
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COc1ccc(cc1)C(c1ccc(cc1)F)O
Complexity: 218
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: 2.8
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COc1ccc(cc1)C(c1ccc(cc1)F)O
Complexity:
218
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
2.8
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COc1cc(Cl)ccc1c1ccc(cc1)[N+](=O)[O-]
Complexity: 287
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: 4
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COc1cc(Cl)ccc1c1ccc(cc1)[N+](=O)[O-]
Complexity:
287
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
4
CatalogNumber: AE61979
ChemicalName: Methyl 4-(5-fluoro-2-methoxyphenyl)benzoate
CasNumber: 1355246-83-1
MolecularFormula: C15H13FO3
MolecularWeight: 260.2603
MdlNumber: MFCD21332999
Smiles: COC(=O)c1ccc(cc1)c1cc(F)ccc1OC
Complexity: 300
Covalently-bondedUnitCount: 1
HeavyAtomCount: 19
HydrogenBondAcceptorCount: 4
RotatableBondCount: 4
Xlogp3: 3.5
CatalogNumber:
AE61979
ChemicalName:
Methyl 4-(5-fluoro-2-methoxyphenyl)benzoate
CasNumber:
1355246-83-1
MolecularFormula:
C15H13FO3
MolecularWeight:
260.2603
MdlNumber:
MFCD21332999
Smiles:
COC(=O)c1ccc(cc1)c1cc(F)ccc1OC
Complexity:
300
Covalently-bondedUnitCount:
1
HeavyAtomCount:
19
HydrogenBondAcceptorCount:
4
RotatableBondCount:
4
Xlogp3:
3.5