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1-Naphthalenemethanol

CAT: 1299-RG-E141166-01Size: 10 mgDry Ice: NoHazardous: No
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CAT#:1299-RG-E141166-01Size:10 mg
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CAS Number
4780-79-4
Synonyms
Naphthalen-1-ylmethanol
Molecular Formula
C11H10O
Molecular Weight
158.2
Target Alternative Name
Naphthoic Acid
Product Name Synonym
Naphthalen-1-ylmethanol

Chemical Information

1-Naphthalenemethanol

(1-naphthyl)methanol is a naphthylmethanol that is methanol in which one of the hydrogens of the methyl group is replaced by a naphthalen-1-yl group. It has a role as a mouse metabolite.

CAS Number4780-79-4
PubChem CID20908
IUPAC Namenaphthalen-1-ylmethanol
Molecular FormulaC11H10O
Molecular Weight158.20
XLogP2.4
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(=C1)C=CC=C2CO
InChI
InChI=1S/C11H10O/c12-8-10-6-3-5-9-4-1-2-7-11(9)10/h1-7,12H,8H2
InChIKey
PBLNHHSDYFYZNC-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 1-Naphthalenemethanol
CAS: 4780-79-4
CID: 20908
Formula: C11H10O
MW: 158.20
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight158.20
XLogP32.4
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