Acetic acid, 2-(4-(4-chlorobenzyl)phenoxy)-
Basic information
- CAS
57081-28-4- Standard SMILES
O=C(O)COc1ccc(Cc2ccc(Cl)cc2)cc1- InChIKey
KEOXZEOPNONABY-UHFFFAOYSA-N- Molecular formula
- C15H13ClO3
- Average molar mass
- 276.71 g/mol
- Monoisotopic mass
- 276.055322
Names & identifiers
- Preferred name
- Acetic acid, 2-(4-(4-chlorobenzyl)phenoxy)-
- IUPAC
- 2-[4-[(4-chlorophenyl)methyl]phenoxy]acetic acid
Names & synonyms
Sgd 62-74BRN 198711657081-28-4ACETIC ACID, 2-(4-(4-CHLOROBENZYL)PHENOXY)-2-(4-(4-Chlorobenzyl)phenoxy)acetic acidAcetic acid, (4-((4-chlorophenyl)methyl)phenoxy)-DTXSID60205690RefChem:316458DTXCID90128181SCHEMBL11377919KEOXZEOPNONABY-UHFFFAOYSA-N4-(4'-chlorobenzyl)-phenoxy acetic acid
Show more names
{4-[(4-Chlorophenyl)methyl]phenoxy}acetic acid
Database identifiers
- CAS
57081-28-4- PubChem CID
- 42121
- DTXSID
DTXSID60205690- Nikkaji
- J85.210D
Properties
Computed structural properties
- XLogP
- 4.2
- Topological polar surface area
- 46.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 279
Related reactions
3 records
Compound notes
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