AB66740
97888-80-7 | 4-Benzyloxy-3,5-dimethylbenzoic acid
Manufacturer: A2B Chem
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CatalogNumber
AB66740
ChemicalName
4-Benzyloxy-3,5-dimethylbenzoic acid
CasNumber
97888-80-7
MolecularFormula
C16H16O3
MolecularWeight
256.2964
MdlNumber
MFCD00272572
Smiles
OC(=O)c1cc(C)c(c(c1)C)OCc1ccccc1
Complexity
284
Covalently-bondedUnitCount
1
HeavyAtomCount
19
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
4
Xlogp3
3.6
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CatalogNumber: AB66740
ChemicalName: 4-Benzyloxy-3,5-dimethylbenzoic acid
CasNumber: 97888-80-7
MolecularFormula: C16H16O3
MolecularWeight: 256.2964
MdlNumber: MFCD00272572
Smiles: OC(=O)c1cc(C)c(c(c1)C)OCc1ccccc1
Complexity: 284
Covalently-bondedUnitCount: 1
HeavyAtomCount: 19
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 4
Xlogp3: 3.6
CatalogNumber:
AB66740
ChemicalName:
4-Benzyloxy-3,5-dimethylbenzoic acid
CasNumber:
97888-80-7
MolecularFormula:
C16H16O3
MolecularWeight:
256.2964
MdlNumber:
MFCD00272572
Smiles:
OC(=O)c1cc(C)c(c(c1)C)OCc1ccccc1
Complexity:
284
Covalently-bondedUnitCount:
1
HeavyAtomCount:
19
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
4
Xlogp3:
3.6
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Nc1ccc(c(c1)Cl)OCc1ccccc1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Nc1ccc(c(c1)Cl)OCc1ccccc1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Clc1cc(ccc1OCc1ccccc1)[N+](=O)[O-]
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Clc1cc(ccc1OCc1ccccc1)[N+](=O)[O-]
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AB66743
ChemicalName: 4-Benzyloxy-3-methoxybenzaldehyde
CasNumber: 2426-87-1
MolecularFormula: C15H14O3
MolecularWeight: 242.2699
MdlNumber: MFCD00003365
Smiles: COc1cc(C=O)ccc1OCc1ccccc1
Complexity: 248
Covalently-bondedUnitCount: 1
HeavyAtomCount: 18
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: __
RotatableBondCount: 5
Xlogp3: 2.8
CatalogNumber:
AB66743
ChemicalName:
4-Benzyloxy-3-methoxybenzaldehyde
CasNumber:
2426-87-1
MolecularFormula:
C15H14O3
MolecularWeight:
242.2699
MdlNumber:
MFCD00003365
Smiles:
COc1cc(C=O)ccc1OCc1ccccc1
Complexity:
248
Covalently-bondedUnitCount:
1
HeavyAtomCount:
18
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
__
RotatableBondCount:
5
Xlogp3:
2.8