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2-Chloro-1，3-propanediol - ≥98%, high purity , CAS No.497-04-1

COA

Grade & Purity:

≥98%

Cas Number: 497-04-1
Molecular Weight: 110.54
PubChem CID: 10337

In stock

Item Number

C693452

Grouped product items
SKU	Size	Availability	Price	Qty
C693452-100mg	100mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$399.90
C693452-250mg	250mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$799.90

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Alcohol ethers (1)

Basic Description

Synonyms	2-MCPD \| 2-Monochloro-propanediol \| Glycerol β-chlorohydrin \| 2-Chloropropane-1,3-diol \| 1,3-Propanediol, 2-chloro- \| Glycerol beta-chlorohydrin
Specifications & Purity	≥98%
Storage Temp	Store at -20°C,Argon charged
Shipped In	Ice chest + Ice pads This product requires cold chain shipping. Ground and other economy services are not available.

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organohalogen compounds
  - Class Halohydrins
    - Subclass Chlorohydrins

Kingdom	Organic compounds
Superclass	Organohalogen compounds
Class	Halohydrins
Subclass	Chlorohydrins
Intermediate Tree Nodes	Not available
Direct Parent	Chlorohydrins
Alternative Parents	Primary alcohols Organochlorides Hydrocarbon derivatives Alkyl chlorides
Molecular Framework	Aliphatic acyclic compounds
Substituents	Chlorohydrin - Organic oxygen compound - Hydrocarbon derivative - Primary alcohol - Organooxygen compound - Organochloride - Alkyl halide - Alkyl chloride - Alcohol - Aliphatic acyclic compound
Description	This compound belongs to the class of organic compounds known as chlorohydrins. These are alcohols substituted by a chlorine atom at a saturated carbon atom otherwise bearing only hydrogen or hydrocarbyl groups.
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	2-chloropropane-1,3-diol
INCHI	InChI=1S/C3H7ClO2/c4-3(1-5)2-6/h3,5-6H,1-2H2
InChIKey	DYPJJAAKPQKWTM-UHFFFAOYSA-N
Smiles	C(C(CO)Cl)O
Isomeric SMILES	C(C(CO)Cl)O
PubChem CID	10337
Molecular Weight	110.54

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

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

Analytical Chart:

Chemical and Physical Properties

Molecular Weight	110.540 g/mol
XLogP3	-1.000
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	2
Exact Mass	110.013 Da
Monoisotopic Mass	110.013 Da
Topological Polar Surface Area	40.500 Å²
Heavy Atom Count	6
Formal Charge	0
Complexity	28.000
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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