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Crotyl Chloride (cis- and trans- mixture, contains ≤38% 3-Chloro-1-butene) - >62.0%(GC), high purity , CAS No.591-97-9

1 Citations

COA

Grade & Purity:

≥62%(GC)

Cas Number: 591-97-9
Molecular Weight: 90.55
Beilstein Registry Number: 1(2)176
MDL number: MFCD00000987
PubChem CID: 637923
PubChem SID: 488190865

In stock

Item Number

C153917

Grouped product items
SKU	Size	Availability	Price	Qty
C153917-25ml	25ml	8	$38.90
C153917-100ml	100ml	3	$140.90

View related series

Halogenated alkene (35) Non heterocyclic block (8163)

Basic Description

Synonyms	.alpha.-Chloro-.beta.-butylene \| (E)-1-chloranylbut-2-ene \| TRANS-BUT-2-ENYL CHLORIDE \| Krotylchlorid \| DTXSID10884116 \| MFCD00000987 \| 2-BUTENE, 1-CHLORO-, TRANS- \| UNII-XX3QN28JUX \| Crotyl chloride,predominantly trans \| Krotylchlorid [Czech] \| UNII-G6Y5
Specifications & Purity	≥62%(GC)
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organohalogen compounds
  - Class Organochlorides

Kingdom	Organic compounds
Superclass	Organohalogen compounds
Class	Organochlorides
Subclass	Not available
Intermediate Tree Nodes	Not available
Direct Parent	Organochlorides
Alternative Parents	Hydrocarbon derivatives Alkyl chlorides
Molecular Framework	Aliphatic acyclic compounds
Substituents	Hydrocarbon derivative - Organochloride - Alkyl halide - Alkyl chloride - Aliphatic acyclic compound
Description	This compound belongs to the class of organic compounds known as organochlorides. These are compounds containing a chemical bond between a carbon atom and a chlorine atom.
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

Pubchem Sid	488190865
Pubchem Sid Url	https://pubchem.ncbi.nlm.nih.gov/substance/488190865
IUPAC Name	(E)-1-chlorobut-2-ene
INCHI	InChI=1S/C4H7Cl/c1-2-3-4-5/h2-3H,4H2,1H3/b3-2+
InChIKey	YTKRILODNOEEPX-NSCUHMNNSA-N
Smiles	CC=CCCl
Isomeric SMILES	C/C=C/CCl
RTECS	EM4264000
Molecular Weight	90.55
Beilstein	1(2)176
Reaxy-Rn	605304
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=605304&ln=

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

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

Analytical Chart:

Find and download the COA for your product by matching the lot number on the packaging.

6 results found

Lot Number	Certificate Type	Date	Item
C1904022	Certificate of Analysis	Jul 15, 2024	C153917
F2225064	Certificate of Analysis	Apr 15, 2024	C153917
F2225143	Certificate of Analysis	Apr 15, 2024	C153917
F2110142	Certificate of Analysis	Mar 15, 2023	C153917
C2218048	Certificate of Analysis	Mar 21, 2022	C153917
C2330510	Certificate of Analysis	Mar 21, 2022	C153917

Chemical and Physical Properties

Refractive Index	1.4350 to 1.4370
Flash Point(°F)	-19°C
Flash Point(°C)	-19°C
Boil Point(°C)	83°C
Molecular Weight	90.550 g/mol
XLogP3	1.700
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	0
Rotatable Bond Count	1
Exact Mass	90.0236 Da
Monoisotopic Mass	90.0236 Da
Topological Polar Surface Area	0.000 Å²
Heavy Atom Count	5
Formal Charge	0
Complexity	30.600
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	1
Undefined Bond Stereocenter Count	0
The total count of all stereochemical bonds	1
Covalently-Bonded Unit Count	1

Citations of This Product

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