AB54105
85-54-1 | 2-(4-Chloro-3-nitrobenzoyl)benzoic acid
Manufacturer: A2B Chem
The price for this product is unavailable. Please request a quote
CatalogNumber
AB54105
ChemicalName
2-(4-Chloro-3-nitrobenzoyl)benzoic acid
CasNumber
85-54-1
MolecularFormula
C14H8ClNO5
MolecularWeight
305.67
MdlNumber
MFCD00007082
Smiles
O=C(c1ccccc1C(=O)O)c1ccc(c(c1)[N+](=O)[O-])Cl
NscNumber
15366
Complexity
436
Covalently-bondedUnitCount
1
HeavyAtomCount
21
HydrogenBondAcceptorCount
5
HydrogenBondDonorCount
1
RotatableBondCount
3
Xlogp3
3.4
Compare Similar Items
Show Difference
CatalogNumber: AB54105
ChemicalName: 2-(4-Chloro-3-nitrobenzoyl)benzoic acid
CasNumber: 85-54-1
MolecularFormula: C14H8ClNO5
MolecularWeight: 305.67
MdlNumber: MFCD00007082
Smiles: O=C(c1ccccc1C(=O)O)c1ccc(c(c1)[N+](=O)[O-])Cl
NscNumber: 15366
Complexity: 436
Covalently-bondedUnitCount: 1
HeavyAtomCount: 21
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 1
RotatableBondCount: 3
Xlogp3: 3.4
CatalogNumber:
AB54105
ChemicalName:
2-(4-Chloro-3-nitrobenzoyl)benzoic acid
CasNumber:
85-54-1
MolecularFormula:
C14H8ClNO5
MolecularWeight:
305.67
MdlNumber:
MFCD00007082
Smiles:
O=C(c1ccccc1C(=O)O)c1ccc(c(c1)[N+](=O)[O-])Cl
NscNumber:
15366
Complexity:
436
Covalently-bondedUnitCount:
1
HeavyAtomCount:
21
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
1
RotatableBondCount:
3
Xlogp3:
3.4
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: N#CCOc1ccc(cc1)Cl
NscNumber: __
Complexity: 155
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 2.3
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
N#CCOc1ccc(cc1)Cl
NscNumber:
__
Complexity:
155
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
2.3
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CC(C(c1ccc(cc1)Cl)C(=O)Cl)C
NscNumber: __
Complexity: 196
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 4.4
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CC(C(c1ccc(cc1)Cl)C(=O)Cl)C
NscNumber:
__
Complexity:
196
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
4.4
CatalogNumber: AB54108
ChemicalName: 2-(4-Ethoxyphenyl)-2-methylpropanol
CasNumber: 83493-63-4
MolecularFormula: C12H18O2
MolecularWeight: 194.2701
MdlNumber: MFCD07787279
Smiles: CCOc1ccc(cc1)C(CO)(C)C
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
AB54108
ChemicalName:
2-(4-Ethoxyphenyl)-2-methylpropanol
CasNumber:
83493-63-4
MolecularFormula:
C12H18O2
MolecularWeight:
194.2701
MdlNumber:
MFCD07787279
Smiles:
CCOc1ccc(cc1)C(CO)(C)C
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__