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3- (Hydroxymethyl) -1-adamantol

CAT: 1459-CS-O-16586Size: 1 EachDry Ice: NoHazardous: No
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CAT#:1459-CS-O-16586Size:1 Each
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Description
3- (Hydroxymethyl) -1-adamantol is listed under Metabolite and is intended for analytical research, quality control and pharmaceutical reference standard applications. It is associated with Adamantane. The product is supplied by Clearsynth under CAT No. CS-O-16586. Clearsynth provides this compound for research and analytical use, with product information including CAS number, molecular formula, molecular weight and product enquiry details.
Overview
Metabolite of Adamantane.
CAS Number
38584-37-1
Synonyms
3- (Hydroxymethyl) -1-adamantol
Molecular Formula
C 11 H 18 O 2
Molecular Weight
182.26
Additionnal Information
3- (Hydroxymethyl) -1-adamantol is supplied with detailed characterization data compliant with regulatory guideline. 3- (Hydroxymethyl) -1-adamantol can be used for analytical method development, method validation (AMV), Quality Control (QC) application for Abbreviated New Drug Application (ANDA), or during commercial production of Adamantane.
Storage Conditions
Refer MSDS for complete information.
Applications Notes
Metabolite of Adamantane.
HSN Code
38229010
Hazard Compound
Refer MSDS for complete information.

Chemical Information

3-(Hydroxymethyl)adamantan-1-ol

See also: 1-Hydroxy-3-adamantylmethanol (annotation moved to).

CAS Number38584-37-1
PubChem CID12070475
IUPAC Name3-(hydroxymethyl)adamantan-1-ol
Molecular FormulaC11H18O2
Molecular Weight182.26
XLogP1
Topological Polar Surface Area40.5
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count2
Rotatable Bond Count1
Heavy Atom Count13
Formal Charge0
Complexity222
SMILES
C1C2CC3(CC1CC(C2)(C3)O)CO
InChI
InChI=1S/C11H18O2/c12-7-10-2-8-1-9(3-10)5-11(13,4-8)6-10/h8-9,12-13H,1-7H2
InChIKey
FORAJDRXEYKDFJ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 3-(Hydroxymethyl)adamantan-1-ol
CAS: 38584-37-1
CID: 12070475
Formula: C11H18O2
MW: 182.26
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight182.26
XLogP31
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count2
Rotatable Bond Count1
Exact Mass182.130679813
Monoisotopic Mass182.130679813
Topological Polar Surface Area40.5 Ų
Heavy Atom Count13
Formal Charge0
Complexity222
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count2
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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