AE61979
1355246-83-1 | Methyl 4-(5-fluoro-2-methoxyphenyl)benzoate
Manufacturer: A2B Chem
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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
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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
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Fc1cc(Br)c(cc1C(F)(F)F)Cl
Complexity: 184
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: 4.2
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Fc1cc(Br)c(cc1C(F)(F)F)Cl
Complexity:
184
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
4.2
CatalogNumber: AE61981
ChemicalName: 2-Fluoro-5-(4-nitrophenyl)benzoic acid
CasNumber: 1352317-91-9
MolecularFormula: C13H8FNO4
MolecularWeight: 261.2053
MdlNumber: MFCD20491439
Smiles: [O-][N+](=O)c1ccc(cc1)c1ccc(c(c1)C(=O)O)F
Complexity: 349
Covalently-bondedUnitCount: 1
HeavyAtomCount: 19
HydrogenBondAcceptorCount: 5
RotatableBondCount: 2
Xlogp3: 3
CatalogNumber:
AE61981
ChemicalName:
2-Fluoro-5-(4-nitrophenyl)benzoic acid
CasNumber:
1352317-91-9
MolecularFormula:
C13H8FNO4
MolecularWeight:
261.2053
MdlNumber:
MFCD20491439
Smiles:
[O-][N+](=O)c1ccc(cc1)c1ccc(c(c1)C(=O)O)F
Complexity:
349
Covalently-bondedUnitCount:
1
HeavyAtomCount:
19
HydrogenBondAcceptorCount:
5
RotatableBondCount:
2
Xlogp3:
3
CatalogNumber: AE61982
ChemicalName: 1-{[4-(4-Nitrophenyl)phenyl]carbonyl}piperidine
CasNumber: 1355246-86-4
MolecularFormula: C18H18N2O3
MolecularWeight: 310.3471
MdlNumber: MFCD21332996
Smiles: O=C(c1ccc(cc1)c1ccc(cc1)[N+](=O)[O-])N1CCCCC1
Complexity: 413
Covalently-bondedUnitCount: 1
HeavyAtomCount: 23
HydrogenBondAcceptorCount: 3
RotatableBondCount: 2
Xlogp3: 3.7
CatalogNumber:
AE61982
ChemicalName:
1-{[4-(4-Nitrophenyl)phenyl]carbonyl}piperidine
CasNumber:
1355246-86-4
MolecularFormula:
C18H18N2O3
MolecularWeight:
310.3471
MdlNumber:
MFCD21332996
Smiles:
O=C(c1ccc(cc1)c1ccc(cc1)[N+](=O)[O-])N1CCCCC1
Complexity:
413
Covalently-bondedUnitCount:
1
HeavyAtomCount:
23
HydrogenBondAcceptorCount:
3
RotatableBondCount:
2
Xlogp3:
3.7