Basic Description

Synonyms	AKOS025117018 \| trans-1,3-Dichlorpropylene \| 1,3-dichioropropene \| 1,3-Dichloropropene \| DTXSID1022057 \| 1, 3-Dichloropropene \| 1,3-dichloro-prop-1-ene \| cis-/trans-1,3-Dichloropropene \| Telone II, technical grade (with 1% epichlorohydrin) \| Telone II, te
Specifications & Purity	technical grade, ≥90%
Grade	technical grade
Product Description	1,3-Dichloropropene (1,3-D) is a clear, light-straw colored liquid. It is a soil fumigant useful for preplanting control of parasitic nematodes. Co-formulations of 1,3-D and chloropicrin are widely employed for preplant fumigation in the production of high-value crops. Application 1,3-Dichloropropene may be employed in commercial fumigant preparations. It is used as pesticide in a study to investigate the photocatalytic degradation of water-soluble pesticides (cymoxanil, methomyl, oxamyl, dimethoate, pyrimethanil and telone) at pilot-plant scale.

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organohalogen compounds
  - Class Vinyl halides
    - Subclass Vinyl chlorides

Kingdom	Organic compounds
Superclass	Organohalogen compounds
Class	Vinyl halides
Subclass	Vinyl chlorides
Intermediate Tree Nodes	Not available
Direct Parent	Vinyl chlorides
Alternative Parents	Chloroalkenes Organochlorides Hydrocarbon derivatives Alkyl chlorides
Molecular Framework	Aliphatic acyclic compounds
Substituents	Chloroalkene - Haloalkene - Vinyl chloride - Hydrocarbon derivative - Organochloride - Alkyl halide - Alkyl chloride - Aliphatic acyclic compound
Description	This compound belongs to the class of organic compounds known as vinyl chlorides. These are vinyl halides in which a chlorine atom is bonded to an sp2-hybridised carbon atom.
External Descriptors	a small molecule
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	1,3-dichloroprop-1-ene
INCHI	InChI=1S/C3H4Cl2/c4-2-1-3-5/h1-2H,3H2
InChIKey	UOORRWUZONOOLO-UHFFFAOYSA-N
Smiles	C(C=CCl)Cl
Isomeric SMILES	C(C=CCl)Cl
WGK Germany	3
RTECS	UC8310000
UN Number	2047
Packing Group	II
Molecular Weight	110.97
Beilstein	1719556
Reaxy-Rn	1719556
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1719556&ln=

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

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

Analytical Chart:

Chemical and Physical Properties

Refractive Index	1.472
Flash Point(°F)	25°C
Flash Point(°C)	28°C
Boil Point(°C)	97-112°C
Molecular Weight	110.970 g/mol
XLogP3	1.700
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	0
Rotatable Bond Count	1
Exact Mass	109.969 Da
Monoisotopic Mass	109.969 Da
Topological Polar Surface Area	0.000 Å²
Heavy Atom Count	5
Formal Charge	0
Complexity	31.900
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	1
The total count of all stereochemical bonds	1
Covalently-Bonded Unit Count	1

Citations of This Product

How to Cite Aladdin Scientific Products?

1. Yong Fan, Jing Lu, Zelin Yu, Xiao Qu, Shuang Guan. (2022) 1,3-Dichloro-2-propanol-Induced Renal Tubular Cell Necroptosis through the ROS/RIPK3/MLKL Pathway. JOURNAL OF AGRICULTURAL AND FOOD CHEMISTRY, 70 (35): (10847–10857).
2. Jianxia Sun,Shun Bai,Weibin Bai,Feiyan Zou,Lei Zhang,Guoqiang Li,Yunfeng Hu,Mingwei Li,Rian Yan,Zhijian Su,Yadong Huang. (2014-02-13) 1,3-Dichloro-2-propanol inhibits progesterone production through the expression of steroidogenic enzymes and cAMP concentration in Leydig cells.. Food chemistry, 154 (330-336).

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1,3-Dichloropropene - 90%, technical grade, high purity , CAS No.542-75-6