Basic information
- CAS
1214-47-7- Standard SMILES
O=C(/C=C/c1ccccc1)c1ccccc1O- InChIKey
AETKQQBRKSELEL-ZHACJKMWSA-N- Molecular formula
- C15H12O2
- Average molar mass
- 224.25 g/mol
- Monoisotopic mass
- 224.08372962
Overview
2'-hydroxychalcone is a member of the class of chalcones that is trans-chalcone substituted by a hydroxy group at position 2'. It has a role as an anti-inflammatory agent. It is a member of chalcones and a member of phenols. It is functionally related to a trans-chalcone.
Names & identifiers
- Preferred name
- 2'-Hydroxychalcone
- IUPAC
- (E)-1-(2-hydroxyphenyl)-3-phenylprop-2-en-1-one
- English name
- (E)-2'-hydroxychalcone
- Molecular formula
- C15H12O2
- Molecular weight
- 224.25
Names & synonyms
2'-Hydroxychalcone1214-47-7(E)-1-(2-hydroxyphenyl)-3-phenylprop-2-en-1-one1-(2-Hydroxyphenyl)-3-phenyl-2-propen-1-one(2E)-1-(2-hydroxyphenyl)-3-phenylprop-2-en-1-oneVY06DZ94OCNSC-18939NSC-170284CHEBI:27916RVC-556DTXSID9061627RefChem:908433
Show more names
NSC 170284(E)-2'-hydroxyone(E)-2'-Hydroxychalcontrans-2'-Hydroxychalcon2-Hydroxy-trans-chalcone2-(trans-Cinnamoyl)phenoltrans-2'-Hydroxycinnamophenone(E)-o-Hydroxyphenyl Styryl Ketone
DTXCID5033709212-962-0214-928-0888-12-01-(2-hydroxyphenyl)-3-phenylprop-2-en-1-one(E)-2'-Hydroxychalconeo-HydroxychalconeChalcone, 2'-hydroxy-
Database identifiers
- CAS
1214-47-7、888-12-0- PubChem CID
- 638276
- DTXSID
DTXSID001313416
Properties
Computed structural properties
- XLogP
- 3.9
- Topological polar surface area
- 37.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 277
Experimental & physicochemical properties
Endocrine DisruptorsPotential endocrine disrupting compound
Physicochemical properties
- Melting point
- 88 °C · 88 °C
- storage temp.
- Refrigerator
- solubility
- Chloroform, Ethyl Acetate, Methanol
- form
- Solid
- color
- Yellow
- FDA UNII
- 6 DZ94OC · VY06DZ94OC
- HS Code
- 2914.5 · 2914.50.3000
Safety & regulation
GHS classification
GHS Classification
This chemical does not meet GHS hazard criteria for 2% (1 of 49) of reports.
Warning
H315 (89.8%): 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 49 reports by companies from 6 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Regulatory InformationREACH registered substance: 2'-hydroxychalcone (EC: 214-928-0)
Hazard Classes and CategoriesSkin Irrit. 2 (89.8%)
Safety data
- hs_code
- 2914.50.3000
Chemistry & industry
Pharmacology
Metabolism/Metabolites2p-Hydroxychalcone has known human metabolites that include 2p-Hydroxychalcone, 2p-hydroxy-glucuronide.
Uses & manufacturing
General Manufacturing Information2-Propen-1-one, 1-(2-hydroxyphenyl)-3-phenyl-: ACTIVE
Applications
UsesA synthetic chalcone with antibacterial and potential antitumoral activity.
Upstream & downstream products
Downstream products
Suppliers32 total
成都超九八生物科技有限公司13348960310 13348960310 · [email protected]
Shaanxi Cuikang Pharmaceutical Technology Co., Ltd+86-13119157289 · [email protected]
安徽合诺生物科技有限公司0555-2761852
武汉易泰科技有限公司上海分公司18930552037 · [email protected]
欧利希（湖北）医药科技有限公司17316404525 17316404525 · [email protected]
安徽合诺生物科技有限公司18455579438
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…