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(1R)-2-chloro-1-(4-chlorophenyl)ethanol - 97%, high purity , CAS No.178460-80-5

COA

Grade & Purity:

≥97%

Cas Number: 178460-80-5
Molecular Weight: 191.05
PubChem CID: 15984284

In stock

Item Number

C630439

Grouped product items
SKU	Size	Availability	Price	Qty
C630439-10g	10g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$14.90
C630439-25g	25g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$29.90

Basic Description

Synonyms	F88337 \| (alphaR)-4-Chloro-alpha-(chloromethyl)benzenemethanol \| EN300-87666 \| SCHEMBL2306502 \| (1R)-2-chloro-1-(4-chlorophenyl)ethanol \| PS-18847 \| DTXSID501254776 \| (1R)-2-chloro-1-(4-chlorophenyl)ethan-1-ol
Specifications & Purity	≥97%
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Benzenoids
  - Class Benzene and substituted derivatives
    - Subclass Halobenzenes

Kingdom	Organic compounds
Superclass	Benzenoids
Class	Benzene and substituted derivatives
Subclass	Halobenzenes
Intermediate Tree Nodes	Not available
Direct Parent	Chlorobenzenes
Alternative Parents	Aryl chlorides Secondary alcohols Chlorohydrins Organochlorides Hydrocarbon derivatives Aromatic alcohols Alkyl chlorides
Molecular Framework	Aromatic homomonocyclic compounds
Substituents	Chlorobenzene - Aryl chloride - Aryl halide - Chlorohydrin - Halohydrin - Secondary alcohol - Organohalogen compound - Alkyl chloride - Alcohol - Aromatic alcohol - Hydrocarbon derivative - Organic oxygen compound - Organochloride - Organooxygen compound - Alkyl halide - Aromatic homomonocyclic compound
Description	This compound belongs to the class of organic compounds known as chlorobenzenes. These are compounds containing one or more chlorine atoms attached to a benzene moiety.
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	(1R)-2-chloro-1-(4-chlorophenyl)ethanol
INCHI	InChI=1S/C8H8Cl2O/c9-5-8(11)6-1-3-7(10)4-2-6/h1-4,8,11H,5H2/t8-/m0/s1
InChIKey	FMVSIWSINRIEKZ-QMMMGPOBSA-N
Smiles	C1=CC(=CC=C1C(CCl)O)Cl
Isomeric SMILES	C1=CC(=CC=C1[C@H](CCl)O)Cl
Alternate CAS	178460-80-5
PubChem CID	15984284
Molecular Weight	191.05

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

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

Analytical Chart:

Chemical and Physical Properties

Molecular Weight	191.050 g/mol
XLogP3	2.300
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	2
Exact Mass	189.995 Da
Monoisotopic Mass	189.995 Da
Topological Polar Surface Area	20.200 Å²
Heavy Atom Count	11
Formal Charge	0
Complexity	111.000
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

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