AI50436
438221-04-6 | 3-[(4-Chlorophenoxy)methyl]-4-methoxybenzoic acid
Manufacturer: A2B Chem
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CatalogNumber
AI50436
ChemicalName
3-[(4-Chlorophenoxy)methyl]-4-methoxybenzoic acid
CasNumber
438221-04-6
MolecularFormula
C15H13ClO4
MolecularWeight
292.7143
MdlNumber
MFCD03419428
Smiles
COc1ccc(cc1COc1ccc(cc1)Cl)C(=O)O
Complexity
315
Covalently-bondedUnitCount
1
HeavyAtomCount
20
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
1
RotatableBondCount
5
Xlogp3
3.5
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CatalogNumber: AI50436
ChemicalName: 3-[(4-Chlorophenoxy)methyl]-4-methoxybenzoic acid
CasNumber: 438221-04-6
MolecularFormula: C15H13ClO4
MolecularWeight: 292.7143
MdlNumber: MFCD03419428
Smiles: COc1ccc(cc1COc1ccc(cc1)Cl)C(=O)O
Complexity: 315
Covalently-bondedUnitCount: 1
HeavyAtomCount: 20
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 5
Xlogp3: 3.5
CatalogNumber:
AI50436
ChemicalName:
3-[(4-Chlorophenoxy)methyl]-4-methoxybenzoic acid
CasNumber:
438221-04-6
MolecularFormula:
C15H13ClO4
MolecularWeight:
292.7143
MdlNumber:
MFCD03419428
Smiles:
COc1ccc(cc1COc1ccc(cc1)Cl)C(=O)O
Complexity:
315
Covalently-bondedUnitCount:
1
HeavyAtomCount:
20
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
5
Xlogp3:
3.5
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COc1ccc(cc1COc1ccc(cc1)Br)C(=O)O
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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__
ChemicalName:
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CasNumber:
__
MolecularFormula:
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MolecularWeight:
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MdlNumber:
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Smiles:
COc1ccc(cc1COc1ccc(cc1)Br)C(=O)O
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
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ChemicalName: __
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MolecularFormula: __
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Smiles: O=Cc1ccc(cc1)OCc1cc(C=O)ccc1OC
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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MolecularFormula:
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MolecularWeight:
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Smiles:
O=Cc1ccc(cc1)OCc1cc(C=O)ccc1OC
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
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RotatableBondCount:
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Xlogp3:
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MolecularFormula: __
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Smiles: CCOC(=O)C(c1ccccc1Cl)C#N
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCOC(=O)C(c1ccccc1Cl)C#N
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__