AA89878
167627-35-2 | 4-(4-Benzyloxyphenyl)-3-methylbenzoic acid
Manufacturer: A2B Chem
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CatalogNumber
AA89878
ChemicalName
4-(4-Benzyloxyphenyl)-3-methylbenzoic acid
CasNumber
167627-35-2
MolecularFormula
C21H18O3
MolecularWeight
318.3658
MdlNumber
MFCD18322890
Smiles
OC(=O)c1ccc(c(c1)C)c1ccc(cc1)OCc1ccccc1
Complexity
394
Covalently-bondedUnitCount
1
HeavyAtomCount
24
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
5
Xlogp3
4.9
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CatalogNumber: AA89878
ChemicalName: 4-(4-Benzyloxyphenyl)-3-methylbenzoic acid
CasNumber: 167627-35-2
MolecularFormula: C21H18O3
MolecularWeight: 318.3658
MdlNumber: MFCD18322890
Smiles: OC(=O)c1ccc(c(c1)C)c1ccc(cc1)OCc1ccccc1
Complexity: 394
Covalently-bondedUnitCount: 1
HeavyAtomCount: 24
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 5
Xlogp3: 4.9
CatalogNumber:
AA89878
ChemicalName:
4-(4-Benzyloxyphenyl)-3-methylbenzoic acid
CasNumber:
167627-35-2
MolecularFormula:
C21H18O3
MolecularWeight:
318.3658
MdlNumber:
MFCD18322890
Smiles:
OC(=O)c1ccc(c(c1)C)c1ccc(cc1)OCc1ccccc1
Complexity:
394
Covalently-bondedUnitCount:
1
HeavyAtomCount:
24
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
5
Xlogp3:
4.9
CatalogNumber: __
ChemicalName: __
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MolecularFormula: __
MolecularWeight: __
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Smiles: Oc1ccc(c(c1)O)c1ccc(cc1)C(=O)O
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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MolecularFormula:
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MolecularWeight:
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Smiles:
Oc1ccc(c(c1)O)c1ccc(cc1)C(=O)O
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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Xlogp3:
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CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Oc1cccc(c1c1ccc(cc1)C(=O)O)O
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
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MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
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Smiles:
Oc1cccc(c1c1ccc(cc1)C(=O)O)O
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: [O-][N+](=O)c1cc(ccc1n1cncc1)C(=O)O
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
[O-][N+](=O)c1cc(ccc1n1cncc1)C(=O)O
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__