Basic information
- CAS
21409-25-6- Standard SMILES
COC(C(=O)O)(c1ccccc1)c1ccccc1- InChIKey
YNDNIPMGZASSRG-UHFFFAOYSA-N- Molecular formula
- C15H14O3
- Average molar mass
- 242.27 g/mol
- Monoisotopic mass
- 242.0942943
Overview
structure given in first source
Names & identifiers
- Preferred name
- Diphenylmethoxyacetic acid
- IUPAC
- 2-methoxy-2,2-diphenylacetic acid
- English name
- diphenylmethoxyacetic acid
- Molecular formula
- C15H14O3
- Molecular weight
- 242.27
Names & synonyms
DPMA acid(diphenylmethoxy)acetateRefChem:920414(diphenylmethoxy)acetic acidDiphenylmethoxyacetic acid2-methoxy-2,2-diphenylacetic acid7475-61-82-methoxy-2,2-diphenyl-acetic acidAcide diphenylmethoxyacetique [French]BRN 2530513methoxy(diphenyl)acetic acidUNII-5EX98UAT82
Show more names
2-(benzhydryloxy)acetic acid2-(Diphenylmethoxy)acetic AcidAcetic acid, 2-(diphenylmethoxy)-
Oprea1_292492SCHEMBL340836methoxy (diphenyl acetic acid)YNDNIPMGZASSRG-UHFFFAOYSA-NDTXSID701380284NSC400473STK526412AKOS000211898
Database identifiers
- CAS
21409-25-6、7475-61-8- PubChem CID
- 30620
- DTXSID
DTXSID701380284
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 46.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 257
Physicochemical properties
- Melting point
- 99 · 99-100 °C
- Boiling point
- 410.6 · 410.6±30.0 °C(Predicted)
- Density
- 1.19 · 1.190±0.06 g/cm3(Predicted)
- pka
- 3.3 · 3.30±0.10(Predicted)
- FDA UNII
- 5 EX98UAT82 · 5EX98UAT82
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 319 · H319-H335-H302-H315
- Precautionary statements
- 264 · P264-P270-P301+P312-P330-P501-P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H319-H335-H302-H315
- Precautionary statements
- P264-P270-P301+P312-P330-P501-P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362
Chemistry & industry
Applications
Uses2-(diphenylmethoxy)acetic acid is a metabolite of diphenhydramine. Diphenhydramine is used in the treatment of numerous allergic ailments such as allergic rhinitis, asthma, anaphylaxis and others.
Upstream & downstream products
Upstream raw materials
Suppliers18 total
济南百隆化学有限公司[email protected] · [email protected]
湖北瑞玛标物科技有限公司15787879035 15787875101 · [email protected]
南京望知星医药科技有限公司18569809817 · [email protected]
Moxin Chemicals+86-17320513646 +86-17320513646 · [email protected]
深圳振强药物研发有限公司0755-66853366 13670046396 · [email protected]
山东博洛达生物科技有限公司0531-68651502 · [email protected]
常州翔龙医药科技有限公司18915873328 18915873328 · [email protected]
郑州为易化工产品有限公司0371-88888888 qq272369594;2159423853qq · [email protected]
河南誉康卓宁进出口有限公司13393721940 · [email protected]
杭州洁汉化工有限公司
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…