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(3-chlorocyclobutyl)methanol - 97%, high purity , CAS No.15963-47-0

COA

Grade & Purity:

≥97%

Cas Number: 15963-47-0
Molecular Weight: 120.58
PubChem CID: 13813819

In stock

Item Number

C174587

Grouped product items
SKU	Size	Availability	Price	Qty
C174587-1g	1g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$253.90

Basic Description

Synonyms	(3-Chlorocyclobutyl)methanol \| 15963-47-0 \| 3-Chlorocyclobutanemethanol \| Cyclobutanemethanol, 3-chloro- \| MFCD16659929 \| SCHEMBL9366105 \| DTXSID30550326 \| YETIMGFGOCVNQL-UHFFFAOYSA-N \| 1-Chloro-3-hydroxymethylcyclobutane \| AKOS016005537 \| PB34804 \| DS-18304 \| SY097865 \| CS-004408
Specifications & Purity	≥97%
Storage Temp	Room temperature
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organic oxygen compounds
  - Class Organooxygen compounds
    - Subclass Alcohols and polyols

Kingdom	Organic compounds
Superclass	Organic oxygen compounds
Class	Organooxygen compounds
Subclass	Alcohols and polyols
Intermediate Tree Nodes	Not available
Direct Parent	Primary alcohols
Alternative Parents	Organochlorides Hydrocarbon derivatives Alkyl chlorides
Molecular Framework	Aliphatic homomonocyclic compounds
Substituents	Hydrocarbon derivative - Primary alcohol - Organochloride - Organohalogen compound - Alkyl halide - Alkyl chloride - Aliphatic homomonocyclic compound
Description	This compound belongs to the class of organic compounds known as primary alcohols. These are compounds comprising the primary alcohol functional group, with the general structure RCOH (R=alkyl, aryl).
External Descriptors	Not available
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

Names and Identifiers

IUPAC Name	(3-chlorocyclobutyl)methanol
INCHI	InChI=1S/C5H9ClO/c6-5-1-4(2-5)3-7/h4-5,7H,1-3H2
InChIKey	YETIMGFGOCVNQL-UHFFFAOYSA-N
Smiles	C1C(CC1Cl)CO
Isomeric SMILES	C1C(CC1Cl)CO
Molecular Weight	120.58
Reaxy-Rn	3042710
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=3042710&ln=

Certificates（CoA,COO,BSE/TSE and Analysis Chart)

C of A & Other Certificates(BSE/TSE, COO):

Analytical Chart:

Chemical and Physical Properties

Molecular Weight	120.580 g/mol
XLogP3	0.900
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	1
Exact Mass	120.034 Da
Monoisotopic Mass	120.034 Da
Topological Polar Surface Area	20.200 Å²
Heavy Atom Count	7
Formal Charge	0
Complexity	59.100
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
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

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