AA36458
1261970-38-0 | 5-Methoxy-3-(3-methoxyphenyl)benzoic acid
Manufacturer: A2B Chem
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CatalogNumber
AA36458
ChemicalName
5-Methoxy-3-(3-methoxyphenyl)benzoic acid
CasNumber
1261970-38-0
MolecularFormula
C15H14O4
MolecularWeight
258.2693
MdlNumber
MFCD18319505
Smiles
COc1cccc(c1)c1cc(OC)cc(c1)C(=O)O
Complexity
305
Covalently-bondedUnitCount
1
HeavyAtomCount
19
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
1
RotatableBondCount
4
Xlogp3
3
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CatalogNumber: AA36458
ChemicalName: 5-Methoxy-3-(3-methoxyphenyl)benzoic acid
CasNumber: 1261970-38-0
MolecularFormula: C15H14O4
MolecularWeight: 258.2693
MdlNumber: MFCD18319505
Smiles: COc1cccc(c1)c1cc(OC)cc(c1)C(=O)O
Complexity: 305
Covalently-bondedUnitCount: 1
HeavyAtomCount: 19
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 4
Xlogp3: 3
CatalogNumber:
AA36458
ChemicalName:
5-Methoxy-3-(3-methoxyphenyl)benzoic acid
CasNumber:
1261970-38-0
MolecularFormula:
C15H14O4
MolecularWeight:
258.2693
MdlNumber:
MFCD18319505
Smiles:
COc1cccc(c1)c1cc(OC)cc(c1)C(=O)O
Complexity:
305
Covalently-bondedUnitCount:
1
HeavyAtomCount:
19
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
4
Xlogp3:
3
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Fc1cc(Cl)cc(c1)c1ccc(cc1F)C(=O)O
Complexity: 313
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 3.9
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Fc1cc(Cl)cc(c1)c1ccc(cc1F)C(=O)O
Complexity:
313
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
3.9
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COc1cc(Cl)ccc1c1ccc(cc1F)C(=O)O
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COc1cc(Cl)ccc1c1ccc(cc1F)C(=O)O
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AA36461
ChemicalName: 3-(4-Carboxy-3-fluorophenyl)-5-methoxybenzoic acid
CasNumber: 1261970-06-2
MolecularFormula: C15H11FO5
MolecularWeight: 290.2432
MdlNumber: MFCD18321507
Smiles: COc1cc(cc(c1)c1ccc(c(c1)F)C(=O)O)C(=O)O
Complexity: 400
Covalently-bondedUnitCount: 1
HeavyAtomCount: 21
HydrogenBondAcceptorCount: 6
HydrogenBondDonorCount: 2
RotatableBondCount: 4
Xlogp3: 2.7
CatalogNumber:
AA36461
ChemicalName:
3-(4-Carboxy-3-fluorophenyl)-5-methoxybenzoic acid
CasNumber:
1261970-06-2
MolecularFormula:
C15H11FO5
MolecularWeight:
290.2432
MdlNumber:
MFCD18321507
Smiles:
COc1cc(cc(c1)c1ccc(c(c1)F)C(=O)O)C(=O)O
Complexity:
400
Covalently-bondedUnitCount:
1
HeavyAtomCount:
21
HydrogenBondAcceptorCount:
6
HydrogenBondDonorCount:
2
RotatableBondCount:
4
Xlogp3:
2.7