4'-Hydroxy-4-biphenylcarboxylic acid

HCID 301556CAS 58574-03-1
Substructure searchFind similar structures

Basic information

Standard SMILES
O=C(O)c1ccc(-c2ccc(O)cc2)cc1
InChIKey
JTGCXYYDAVPSFD-UHFFFAOYSA-N
Molecular formula
C13H10O3
Average molar mass
214.22 g/mol
Monoisotopic mass
214.06299418

Names & identifiers

Preferred name
4'-Hydroxy-4-biphenylcarboxylic acid
IUPAC
4-(4-hydroxyphenyl)benzoic acid
English name
4'-Hydroxy-4-biphenylcarboxylic acid
Molecular formula
C13H10O3
Molecular weight
214.22

Names & synonyms

58574-03-14'-Hydroxy-4-biphenylcarboxylic acidDTXSID60306717RefChem:506142DTXCID90257844628-295-7InChI=1/C13H10O3/c14-12-7-5-10(6-8-12)9-1-3-11(4-2-9)13(15)16/h1-8,14H,(H,15,164-(4-Hydroxyphenyl)benzoic acid4'-Hydroxy-[1,1'-biphenyl]-4-carboxylic acid4'-Hydroxybiphenyl-4-carboxylic Acid4-Hydroxy-4'-biphenylcarboxylic acidMFCD00059078
Show more names
AKOS BAR-1038RARECHEM AL BO 05374'-Hydroxy-4-biphenyL4-(4-CARBOXYPHENYL)-PHENOL4'-Hydroxy-4-biphenylcarbox4-(4-hydroxycyclohexyl)benzoate
[1,1'-Biphenyl]-4-carboxylic acid, 4'-hydroxy-4'-Hydroxy biphenyl-4-carboxylic acid4'-Hydroxy[1,1'-biphenyl]-4-carboxylic acid4-Hydroxybiphenyl-4'-carboxylic acid4'-Hydroxy-biphenyl-4-carboxylic acidCHEMBL905224-(4'-hydroxyphenyl)benzoic acidNSC179419

Database identifiers

CAS
58574-03-1
PubChem CID
301556
DTXSID
DTXSID60306717
ChEMBL
CHEMBL90522
EC Number
628-295-7
Nikkaji
J208.616F

Properties

Computed structural properties

XLogP
3.2
Topological polar surface area
57.5 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
3
Rotatable bonds
2
Heavy atoms
16

Physicochemical properties

Melting point
295 °C · 295 °C (dec.)(lit.)
Boiling point
314.35 °C · 314.35°C (rough estimate)
Density
1.1956 · 1.1956 (rough estimate)
refractive index
1.509 · 1.5090 (estimate)
storage temp.
Sealed in dry,Room Temperature
solubility
almost transparency in hot Methanol

Safety & regulation

GHS classification

GHS Classification · 4 items

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 44 reports by companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Hazard information

Hazard Classes and CategoriesSkin Irrit. 2 (100%)

Safety data

PPE
dust mask type N95 (US), Eyeshields, Gloves
wgk
3
hs_code
29163990
risk_code
36/37/38-37/38-36
Signal word
Warning
Symbol(GHS)
GHS07

Chemistry & industry

Applications

Uses4-(4-Hydroxyphenyl)benzoic acid Dyes and metabolites.

UsesIntermediates of Liquid Crystals

Upstream & downstream products

Suppliers50 total

北京华美互利生物化工010-56205725 · [email protected]
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
温州共赢化学有限公司+86-0086-577-64498589 +86-15355981851 · [email protected]
INTATRADE GmbH+49 3493/605464 · [email protected]

Related reactions

102 records
New reaction record

Linked notes

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