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2-Naphthalenemethanol (Standard)

CAT: 0804-HY-W001953R-01Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0804-HY-W001953R-01Size:5 mg
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Description
2-Naphthalenemethanol is the metabolite of environmental pollutant 2-methylnaphthalene. 2-Naphthalenemethanol covalently binds to alveolar protein and induces pulmonary toxicity[1].
CAS Number
1592-38-7
UNSPSC
12352005
Target
Endogenous Metabolite
Related Pathways
Metabolic Enzyme/Protease
Field of Research
Others
Purity
99.39
Smiles
OCC1=CC2=C(C=CC=C2)C=C1
Molecular Formula
C11H10O
Molecular Weight
158.20
References & Citations
[1]Li K, et al., 2-Naphthalenemethanol participates in metabolic activation of 2-methylnaphthalene. Xenobiotica. 2022 Apr;52 (4) :360-369.
Shipping Conditions
Blue Ice
Storage Conditions
4°C, sealed and dry storage, away from light and moisture
Scientific Category
Reference Standards
Clinical Information
No Development Reported

Chemical Information

2-Naphthalenemethanol

(2-naphthyl)methanol is a naphthylmethanol that is methanol in which one of the methyl hydrogens has been replaced by a (2-naphthyl) group. It has a role as a mouse metabolite and a xenobiotic metabolite.

CAS Number1592-38-7
PubChem CID74128
IUPAC Namenaphthalen-2-ylmethanol
Molecular FormulaC11H10O
Molecular Weight158.20
XLogP2.2
Topological Polar Surface Area20.2
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count1
Heavy Atom Count12
Formal Charge0
Complexity144
SMILES
C1=CC=C2C=C(C=CC2=C1)CO
InChI
InChI=1S/C11H10O/c12-8-9-5-6-10-3-1-2-4-11(10)7-9/h1-7,12H,8H2
InChIKey
MFGWMAAZYZSWMY-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2-Naphthalenemethanol
CAS: 1592-38-7
CID: 74128
Formula: C11H10O
MW: 158.20
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight158.20
XLogP32.2
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count1
Exact Mass158.073164938
Monoisotopic Mass158.073164938
Topological Polar Surface Area20.2 Ų
Heavy Atom Count12
Formal Charge0
Complexity144
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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