CAS 14531-52-3 | 1,3-Benzenediol, 5-(2-phenylethyl)- | CAS Number 14531-52-3

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14531-52-3 | 1,3-Benzenediol, 5-(2-phenylethyl)-

CAS No: 14531-52-3 Catalog No: AG001KSJ MDL No:MFCD16294420

Product Description

Catalog Number:

AG001KSJ

Chemical Name:

1,3-Benzenediol, 5-(2-phenylethyl)-

CAS Number:

14531-52-3

Molecular Formula:

C14H14O2

Molecular Weight:

214.2598

MDL Number:

MFCD16294420

IUPAC Name:

5-(2-phenylethyl)benzene-1,3-diol

InChI:

InChI=1S/C14H14O2/c15-13-8-12(9-14(16)10-13)7-6-11-4-2-1-3-5-11/h1-5,8-10,15-16H,6-7H2

InChI Key:

LDBYHULIXFIJAZ-UHFFFAOYSA-N

SMILES:

Oc1cc(CCc2ccccc2)cc(c1)O

Properties

Complexity:

189

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

214.099g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

214.264g/mol

Monoisotopic Mass:

214.099g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

40.5A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

3.4

Literature

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Resveratrol as a kcat type inhibitor for tyrosinase: potentiated melanogenesis inhibitor.	Bioorganic & medicinal chemistry 20120115
Furostanol saponins from the rhizomes of Dioscorea japonica and their effects on NGF induction.	Bioorganic & medicinal chemistry letters 20110401
Bioactive compounds from Bauhinia purpurea possessing antimalarial, antimycobacterial, antifungal, anti-inflammatory, and cytotoxic activities.	Journal of natural products 20070501
Antibacterial constituents from Stemona sessilifolia.	Journal of Asian natural products research 20070101
Inhibition of leukotriene biosynthesis by stilbenoids from Stemona species.	Journal of natural products 20050101
Spasmolytic effects, mode of action, and structure-activity relationships of stilbenoids from Nidema boothii.	Journal of natural products 20040201
Dihydrophenanthrenes and other antifungal stilbenoids from Stemona cf. pierrei.	Phytochemistry 20040101