AE61963
1352318-67-2 | Methyl 3-fluoro-5-(4-nitrophenyl)benzoate
Manufacturer: A2B Chem
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CatalogNumber
AE61963
ChemicalName
Methyl 3-fluoro-5-(4-nitrophenyl)benzoate
CasNumber
1352318-67-2
MolecularFormula
C14H10FNO4
MolecularWeight
275.2319
MdlNumber
MFCD20529493
Smiles
COC(=O)c1cc(F)cc(c1)c1ccc(cc1)[N+](=O)[O-]
Complexity
363
Covalently-bondedUnitCount
1
HeavyAtomCount
20
HydrogenBondAcceptorCount
5
RotatableBondCount
3
Xlogp3
3.3
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CatalogNumber: AE61963
ChemicalName: Methyl 3-fluoro-5-(4-nitrophenyl)benzoate
CasNumber: 1352318-67-2
MolecularFormula: C14H10FNO4
MolecularWeight: 275.2319
MdlNumber: MFCD20529493
Smiles: COC(=O)c1cc(F)cc(c1)c1ccc(cc1)[N+](=O)[O-]
Complexity: 363
Covalently-bondedUnitCount: 1
HeavyAtomCount: 20
HydrogenBondAcceptorCount: 5
RotatableBondCount: 3
Xlogp3: 3.3
CatalogNumber:
AE61963
ChemicalName:
Methyl 3-fluoro-5-(4-nitrophenyl)benzoate
CasNumber:
1352318-67-2
MolecularFormula:
C14H10FNO4
MolecularWeight:
275.2319
MdlNumber:
MFCD20529493
Smiles:
COC(=O)c1cc(F)cc(c1)c1ccc(cc1)[N+](=O)[O-]
Complexity:
363
Covalently-bondedUnitCount:
1
HeavyAtomCount:
20
HydrogenBondAcceptorCount:
5
RotatableBondCount:
3
Xlogp3:
3.3
CatalogNumber: AE61964
ChemicalName: 1-[3-(3-Chloro-4-methylphenyl)phenyl]ethanone
CasNumber: 1355247-05-0
MolecularFormula: C15H13ClO
MolecularWeight: 244.7161
MdlNumber: MFCD21332981
Smiles: CC(=O)c1cccc(c1)c1ccc(c(c1)Cl)C
Complexity: 276
Covalently-bondedUnitCount: 1
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 1
RotatableBondCount: 2
Xlogp3: 4.2
CatalogNumber:
AE61964
ChemicalName:
1-[3-(3-Chloro-4-methylphenyl)phenyl]ethanone
CasNumber:
1355247-05-0
MolecularFormula:
C15H13ClO
MolecularWeight:
244.7161
MdlNumber:
MFCD21332981
Smiles:
CC(=O)c1cccc(c1)c1ccc(c(c1)Cl)C
Complexity:
276
Covalently-bondedUnitCount:
1
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
1
RotatableBondCount:
2
Xlogp3:
4.2
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: C1CCC(CC1)NC(=O)C2=CC=C(C3=CC=CC=C32)Br
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
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MolecularFormula:
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MolecularWeight:
__
MdlNumber:
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Smiles:
C1CCC(CC1)NC(=O)C2=CC=C(C3=CC=CC=C32)Br
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Nc1ccc(cc1)c1cccc(c1)C(=O)N1CCCC1
Complexity: 330
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: 2.8
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Nc1ccc(cc1)c1cccc(c1)C(=O)N1CCCC1
Complexity:
330
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
2.8