Basic information
- CAS
51350-23-3- Standard SMILES
O=C(O)Cc1ccc(-c2ccc(O)cc2)cc1- InChIKey
SUSAZDLJYMQAEJ-UHFFFAOYSA-N- Molecular formula
- C14H12O3
- Average molar mass
- 228.24 g/mol
- Monoisotopic mass
- 228.07864424
Names & identifiers
- Preferred name
- (1,1'-Biphenyl)-4-acetic acid, 4'-hydroxy-
- IUPAC
- 2-[4-(4-hydroxyphenyl)phenyl]acetic acid
- English name
- p-Hydroxybiphenylacetic acid
- Molecular formula
- C14H12O3
- Molecular weight
- 228.24
Names & synonyms
51350-23-3(1,1'-Biphenyl)-4-acetic acid, 4'-hydroxy-p-Hydroxybiphenylacetic acidDTXSID00199347RefChem:203978DTXCID301218384'-Hydroxy-biphenyl-4-acetic acid[1,1'-Biphenyl]-4-aceticacid, 4'-hydroxy-2-[4-(4-hydroxyphenyl)phenyl]acetic acid2-(4'-Hydroxy-[1,1'-biphenyl]-4-yl)acetic acidMFCD11617144SCHEMBL4940811
Show more names
4-Hydroxy-biphenyl-4acetic acid2-[4-(4-hydroxyphenyl)phenyl]aceticaci[1,1-BIPHENYL]-4-ACETIC ACID,4-HYDROXY-4'-Hydroxy(1,1'-biphenyl)-4-acetic acid4'-Hydroxy(1,1'-biphenyl)-4-acetic acid
4-hydroxy-4'-biphenyl-acetic acid(p-Hydroxybiphenyl-4-yl)acetic acid(4'-hydroxy-1,1'-biphenyl-4-yl)acetic acidC78272(4'-Hydroxy[1,1'-biphenyl]-4-yl)acetic acid(4'-Hydroxy[1,1'-biphenyl]-4-yl)acetic acid #2-(4'-Hydroxy-[1,1'-biphenyl]-4-yl)aceticacidF800736
Database identifiers
- CAS
51350-23-3- PubChem CID
- 603371
- DTXSID
DTXSID00199347- Nikkaji
- J530.518G
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 57.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 248
Physicochemical properties
- Melting point
- 241 · 241-243 °C(Solvent: Acetic acid)
- Boiling point
- 434.981 · 434.981±33.00 °C(Press: 760.00 Torr)(predicted)
- Density
- 1.264 · 1.264±0.06 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
- storage temp.
- Store at Room Tem.
- pka
- 4.343 · 4.343±0.10(predicted)
- Appearance
- white solid
- InChI
- InChI=1S/C14H12O3/c15-13-7-5-12(6-8-13)11-3-1-10(2-4-11)9-14(16)17/h1-8,15H,9H2,(H,16,17)
- InChIKey
- SUSAZDLJYMQAEJ-UHFFFAOYSA-N
- SMILES
- C1(C2=CC=C(O)C=C2)=CC=C(CC(O)=O)C=C1
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319-H335
- Precautionary statements
- 264 · P264-P280-P302+P352-P321-P332+P313-P362-P305+P351+P338-P337+P313-P261-P271-P304+P340-P312-P403+P233-P405-P501
Safety & regulation
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H315-H319-H335
- Precautionary statements
- P264-P280-P302+P352-P321-P332+P313-P362-P305+P351+P338-P337+P313-P261-P271-P304+P340-P312-P403+P233-P405-P501
Chemistry & industry
Suppliers10 total
梯希爱（上海）化工贸易有限公司021-61109150 · [email protected]
江苏艾康生物医药研发有限公司025-5885952 15955137747 · [email protected]
上海昶衍化工科技有限公司021-20242659 18930833303 · [email protected]
苏州爱玛特生物科技有限公司0512-56316828 4008675858 · [email protected]
HANGZHOU LEAP CHEM CO., LTD.+86-571-87711850 +86-15355479329 · [email protected]
上海韵浦实业有限公司21-61726900 15202122459
上海索本生物科技有限公司15088289376;13917786310 · [email protected]
上海相辉医药科技有限公司13611835272 13611835272 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
珠海奥博凯生物医药技术有限公司400-0628126 · [email protected]
Related reactions
1 records
Compound notes
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