(R)-(+)-1-(2-Naphthyl)ethanol - ≥97% , CAS No.52193-85-8

CAS: 52193-85-8 Cat. No.: R160840 Molecular Weight: 172.23 Beilstein Registry Number: 3195950

GRADE & PURITY ≥97%

Synonyms

(R)-(+)-alpha-Methyl-2-naphthalenemethanol | FT-0772654 | MFCD00075344 | AKOS015840846 | BDBM50183596 | (R)-(+)-2-(1-Hydroxyethyl)naphthalene | N0784 | (R)-1-(Naphthalen-2-yl)ethanol | SCHEMBL445001 | AKOS012670050 | AXRKCRWZRKETCK-SECBINFHSA-N | (R)-(+)-

Storage

Store at -20°C

Shipped In

Ice chest + Ice pads

Specifications

Synonyms

(R)-(+)-alpha-Methyl-2-naphthalenemethanol | FT-0772654 | MFCD00075344 | AKOS015840846 | BDBM50183596 | (R)-(+)-2-(1-Hydroxyethyl)naphthalene | N0784 | (R)-1-(Naphthalen-2-yl)ethanol | SCHEMBL445001 | AKOS012670050 | AXRKCRWZRKETCK-SECBINFHSA-N | (R)-(+)-

Specifications & Purity

≥97%

Storage

Store at -20°C

Shipped In

Ice chest + Ice pads

This product requires cold chain shipping. Ground and other economy services are not available.

Purity

≥97%

Names and Identifiers

• Pubchem Sid: 504764422
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504764422
• Canonical Smiles: CC(C1=CC2=CC=CC=C2C=C1)O
• IUPAC Name: (1R)-1-naphthalen-2-ylethanol
• InChIKey: AXRKCRWZRKETCK-SECBINFHSA-N
• INCHI: 1S/C12H12O/c1-9(13)11-7-6-10-4-2-3-5-12(10)8-11/h2-9,13H,1H3/t9-/m1/s1
• Isomeric SMILES: C[C@H](C1=CC2=CC=CC=C2C=C1)O
• WGK Germany: 3
• Molecular Weight: 172.23
• Beilstein: 3195950
• Reaxy-Rn: 1907449
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1907449&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Class Naphthalenes

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Class: Naphthalenes
• Subclass: Not available
• Intermediate Tree Nodes: Not available
• Direct Parent: Naphthalenes
• Alternative Parents: Secondary alcohols Hydrocarbon derivatives Aromatic alcohols
• Molecular Framework: Aromatic homopolycyclic compounds
• Substituents: Naphthalene - Secondary alcohol - Organic oxygen compound - Hydrocarbon derivative - Aromatic alcohol - Organooxygen compound - Alcohol - Aromatic homopolycyclic compound
• Description: This compound belongs to the class of organic compounds known as naphthalenes. These are compounds containing a naphthalene moiety, which consists of two fused benzene rings.
• External Descriptors: Not available

Data sources

1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.

DOI: 10.1186/s13321-016-0174-y

Associated Targets(Human)

UGT2B7 Tchem UDP-glucuronosyltransferase 2B7 (787 Activities)

Discover Target: UGT2B7

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Mechanisms of Action

Chemical and Physical Properties

• Solubility: Soluble in Methanol,Toluene
• Specific Rotation[α]: 40° (C=1,MeOH)
• Melt Point(°C): 68-74°C
• Molecular Weight: 172.220 g/mol
• XLogP3: 3.000
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 1
• Exact Mass: 172.089 Da
• Monoisotopic Mass: 172.089 Da
• Topological Polar Surface Area: 20.200 Ų
• Heavy Atom Count: 13
• Formal Charge: 0
• Complexity: 167.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 1
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 1