Basic information
- CAS
85607-79-0- Standard SMILES
COc1cc(OCc2ccccc2)ccc1C(=O)O- InChIKey
SKQWLDXXQLJSHA-UHFFFAOYSA-N- Molecular formula
- C15H14O4
- Average molar mass
- 258.27 g/mol
- Monoisotopic mass
- 258.08920893
Names & identifiers
- Preferred name
- 4-Benzyloxy-2-methoxy-benzoic acid
- IUPAC
- 2-methoxy-4-phenylmethoxybenzoic acid
- English name
- Benzoic acid, 2-methoxy-4-(phenylmethoxy)-
- Molecular formula
- C15H14O4
- Molecular weight
- 258.27
Names & synonyms
85607-79-04-Benzyloxy-2-methoxy-benzoic acid4-(benzyloxy)-2-methoxybenzoic acidBenzoic acid, 2-methoxy-4-(phenylmethoxy)-4-benzyloxy-2-methoxybenzoic acid2-methoxy-4-phenylmethoxybenzoic acidMFCD06203640SCHEMBL1448026DTXSID804243212-methoxy-4-benzyloxybenzoic acidSKQWLDXXQLJSHA-UHFFFAOYSA-N2-methoxy-4-benzyloxy benzoic acid
Show more names
DB-316217CS-0195798E89850F632984A1-15642
Database identifiers
- CAS
85607-79-0- PubChem CID
- 6483408
- DTXSID
DTXSID80424321- Nikkaji
- J1.324.268B
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 55.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 286
Chemistry & industry
Suppliers5 total
安徽合诺生物科技有限公司0555-2761852
安徽合诺生物科技有限公司18455579438
南京代盟化工有限公司02566880956 · [email protected]
ANHUI BYERSEN BIOTECH CO. LTD+86-15385096007 +86-17755058861 · [email protected]
珠海奥博凯生物医药技术有限公司400-0628126 · [email protected]
Related reactions
2 records
Compound notes
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