AA50918
1375069-02-5 | [3-(2-Methylphenyl)phenyl]acetic acid
Manufacturer: A2B Chem
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CatalogNumber
AA50918
ChemicalName
[3-(2-Methylphenyl)phenyl]acetic acid
CasNumber
1375069-02-5
MolecularFormula
C15H14O2
MolecularWeight
226.2705
MdlNumber
MFCD05981056
Smiles
OC(=O)Cc1cccc(c1)c1ccccc1C
Complexity
262
Covalently-bondedUnitCount
1
HeavyAtomCount
17
HydrogenBondAcceptorCount
2
HydrogenBondDonorCount
1
RotatableBondCount
3
Xlogp3
3.6
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CatalogNumber: AA50918
ChemicalName: [3-(2-Methylphenyl)phenyl]acetic acid
CasNumber: 1375069-02-5
MolecularFormula: C15H14O2
MolecularWeight: 226.2705
MdlNumber: MFCD05981056
Smiles: OC(=O)Cc1cccc(c1)c1ccccc1C
Complexity: 262
Covalently-bondedUnitCount: 1
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 1
RotatableBondCount: 3
Xlogp3: 3.6
CatalogNumber:
AA50918
ChemicalName:
[3-(2-Methylphenyl)phenyl]acetic acid
CasNumber:
1375069-02-5
MolecularFormula:
C15H14O2
MolecularWeight:
226.2705
MdlNumber:
MFCD05981056
Smiles:
OC(=O)Cc1cccc(c1)c1ccccc1C
Complexity:
262
Covalently-bondedUnitCount:
1
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
1
RotatableBondCount:
3
Xlogp3:
3.6
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CNC(=O)c1cccc(c1)c1ccc(cc1)CC(=O)O
Complexity: 348
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 2.5
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CNC(=O)c1cccc(c1)c1ccc(cc1)CC(=O)O
Complexity:
348
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
2.5
CatalogNumber: AA50920
ChemicalName: Ethyl 4-[3-(2-ethoxy-2-oxoethyl)phenyl]benzoate
CasNumber: 1375068-97-5
MolecularFormula: C19H20O4
MolecularWeight: 312.3597
MdlNumber: MFCD28016866
Smiles: CCOC(=O)Cc1cccc(c1)c1ccc(cc1)C(=O)OCC
Complexity: 385
Covalently-bondedUnitCount: 1
HeavyAtomCount: 23
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: __
RotatableBondCount: 8
Xlogp3: 3.9
CatalogNumber:
AA50920
ChemicalName:
Ethyl 4-[3-(2-ethoxy-2-oxoethyl)phenyl]benzoate
CasNumber:
1375068-97-5
MolecularFormula:
C19H20O4
MolecularWeight:
312.3597
MdlNumber:
MFCD28016866
Smiles:
CCOC(=O)Cc1cccc(c1)c1ccc(cc1)C(=O)OCC
Complexity:
385
Covalently-bondedUnitCount:
1
HeavyAtomCount:
23
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
__
RotatableBondCount:
8
Xlogp3:
3.9
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Nc1ccn2c(c1)nc(c2)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Nc1ccn2c(c1)nc(c2)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__