AE62443
1355248-18-8 | 3-(4-Benzyloxyphenyl)phenylacetic acid
Manufacturer: A2B Chem
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CatalogNumber
AE62443
ChemicalName
3-(4-Benzyloxyphenyl)phenylacetic acid
CasNumber
1355248-18-8
MolecularFormula
C21H18O3
MolecularWeight
318.3658
MdlNumber
MFCD21332998
Smiles
OC(=O)Cc1cccc(c1)c1ccc(cc1)OCc1ccccc1
Complexity
381
Covalently-bondedUnitCount
1
HeavyAtomCount
24
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
6
Xlogp3
4.3
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CatalogNumber: AE62443
ChemicalName: 3-(4-Benzyloxyphenyl)phenylacetic acid
CasNumber: 1355248-18-8
MolecularFormula: C21H18O3
MolecularWeight: 318.3658
MdlNumber: MFCD21332998
Smiles: OC(=O)Cc1cccc(c1)c1ccc(cc1)OCc1ccccc1
Complexity: 381
Covalently-bondedUnitCount: 1
HeavyAtomCount: 24
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 6
Xlogp3: 4.3
CatalogNumber:
AE62443
ChemicalName:
3-(4-Benzyloxyphenyl)phenylacetic acid
CasNumber:
1355248-18-8
MolecularFormula:
C21H18O3
MolecularWeight:
318.3658
MdlNumber:
MFCD21332998
Smiles:
OC(=O)Cc1cccc(c1)c1ccc(cc1)OCc1ccccc1
Complexity:
381
Covalently-bondedUnitCount:
1
HeavyAtomCount:
24
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
6
Xlogp3:
4.3
CatalogNumber: AE62444
ChemicalName: 5-Formyl-N,N-dimethyl-3-(trifluoromethyl)pyrazole-1-sulfonamide
CasNumber: 1423037-33-5
MolecularFormula: C7H8F3N3O3S
MolecularWeight: 271.2169
MdlNumber: MFCD23135914
Smiles: O=Cc1cc(nn1S(=O)(=O)N(C)C)C(F)(F)F
Complexity: 389
Covalently-bondedUnitCount: 1
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 8
HydrogenBondDonorCount: __
RotatableBondCount: 3
Xlogp3: 0.5
CatalogNumber:
AE62444
ChemicalName:
5-Formyl-N,N-dimethyl-3-(trifluoromethyl)pyrazole-1-sulfonamide
CasNumber:
1423037-33-5
MolecularFormula:
C7H8F3N3O3S
MolecularWeight:
271.2169
MdlNumber:
MFCD23135914
Smiles:
O=Cc1cc(nn1S(=O)(=O)N(C)C)C(F)(F)F
Complexity:
389
Covalently-bondedUnitCount:
1
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
8
HydrogenBondDonorCount:
__
RotatableBondCount:
3
Xlogp3:
0.5
CatalogNumber: AE62445
ChemicalName: 3-Bromo-5-(4-carboxyphenyl)phenol
CasNumber: 1261991-91-6
MolecularFormula: C13H9BrO3
MolecularWeight: 293.1128
MdlNumber: MFCD18316077
Smiles: Oc1cc(Br)cc(c1)c1ccc(cc1)C(=O)O
Complexity: 274
Covalently-bondedUnitCount: 1
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 2
RotatableBondCount: 2
Xlogp3: 3.4
CatalogNumber:
AE62445
ChemicalName:
3-Bromo-5-(4-carboxyphenyl)phenol
CasNumber:
1261991-91-6
MolecularFormula:
C13H9BrO3
MolecularWeight:
293.1128
MdlNumber:
MFCD18316077
Smiles:
Oc1cc(Br)cc(c1)c1ccc(cc1)C(=O)O
Complexity:
274
Covalently-bondedUnitCount:
1
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
2
RotatableBondCount:
2
Xlogp3:
3.4
CatalogNumber: AE62446
ChemicalName: 4-(4-Formylphenyl)-N,N-dimethylbenzamide
CasNumber: 1393442-21-1
MolecularFormula: C16H15NO2
MolecularWeight: 253.2958
MdlNumber: MFCD22383730
Smiles: O=Cc1ccc(cc1)c1ccc(cc1)C(=O)N(C)C
Complexity: 311
Covalently-bondedUnitCount: 1
HeavyAtomCount: 19
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: __
RotatableBondCount: 3
Xlogp3: 2.5
CatalogNumber:
AE62446
ChemicalName:
4-(4-Formylphenyl)-N,N-dimethylbenzamide
CasNumber:
1393442-21-1
MolecularFormula:
C16H15NO2
MolecularWeight:
253.2958
MdlNumber:
MFCD22383730
Smiles:
O=Cc1ccc(cc1)c1ccc(cc1)C(=O)N(C)C
Complexity:
311
Covalently-bondedUnitCount:
1
HeavyAtomCount:
19
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
__
RotatableBondCount:
3
Xlogp3:
2.5