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1,2-Dichloropropane - Standard for GC,≥99.5%(GC), high purity , CAS No.78-87-5

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1,2-Dichloropropane - Standard for GC,≥99.5%(GC), high purity , CAS No.78-87-5

4 Citations

COA

Grade & Purity:

Standard for GC

≥99.5%(GC)

Cas Number: 78-87-5
Molecular Weight: 112.99
Beilstein Registry Number: 1718880
EC Number: 201-152-2
MDL number: MFCD00000868
PubChem CID: 6564

In stock

Item Number

D108186

Grouped product items
SKU	Size	Availability	Price	Qty
D108186-5ml	5ml	5	$25.90

Basic Description

Synonyms	Dwuchloropropan [Polish] \| NCI-C55141 \| 1,2-Dichloropropane 10000 microg/mL in Methanol \| Q161478 \| Bichlorure de propylene \| EN300-120595 \| Propane, 1,2-dichloro- \| Propylene dichloride \| PROPYLENE DICHLORIDE [MI] \| 2,3-dichloropropane \| alpha,beta-Propy
Specifications & Purity	Standard for GC, ≥99.5%(GC)
Shipped In	Normal
Grade	Standard for GC

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	Fumigants
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

Associated Targets(non-human)

Aspergillus nidulans (364 Activities)

Explore this target

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Mechanisms of Action

Mechanism of Action	Action Type	target ID	Target Name	Target Type	Target Organism	Binding Site Name	References

Names and Identifiers

IUPAC Name	1,2-dichloropropane
INCHI	InChI=1S/C3H6Cl2/c1-3(5)2-4/h3H,2H2,1H3
InChIKey	KNKRKFALVUDBJE-UHFFFAOYSA-N
Smiles	CC(CCl)Cl
Isomeric SMILES	CC(CCl)Cl
WGK Germany	3
RTECS	TX9625000
UN Number	1279
Packing Group	II
Molecular Weight	112.99
Beilstein	1718880
Reaxy-Rn	1718880
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1718880&ln=

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

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

Analytical Chart:

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1 results found

Lot Number	Certificate Type	Date	Item
H2202064	Certificate of Analysis	Apr 28, 2024	D108186

Chemical and Physical Properties

Refractive Index	1.439
Flash Point(°C)	（open cup）21℃
Boil Point(°C)	96°C
Melt Point(°C)	-100°C
Molecular Weight	112.980 g/mol
XLogP3	1.800
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	0
Rotatable Bond Count	1
Exact Mass	111.985 Da
Monoisotopic Mass	111.985 Da
Topological Polar Surface Area	0.000 Å²
Heavy Atom Count	5
Formal Charge	0
Complexity	20.900
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
The total count of all stereochemical bonds	0
Covalently-Bonded Unit Count	1

Citations of This Product

How to Cite Aladdin Scientific Products?

1. Wei Wang, Zhensheng Shen, Jiaxiang Zhang, Lun Pan, Chengxiang Shi, Xiangwen Zhang, Ji-Jun Zou. (2024) Synthesis and Performance of Cyclopentadiene-Based Spirocyclopropane High-Energy-Density Fuels. FUEL, 355 (129380).
2. Maogen Zhu, Zhechen Fan, Kangli Xu, Yuting Fang, Wei Sun, Yongchun Zhu. (2022) An Oxygen-Resistant and Self-Eliminating Passivated Layer for Highly Stable Lithium Metal Batteries. ADVANCED FUNCTIONAL MATERIALS, 32 (21): (2112645).
3. Ma Baochen, Zhang Haikuo, Li Ruhong, Zhang Shuoqing, Chen Long, Zhou Tao, Wang Jinze, Zhang Ruixin, Ding Shouhong, Xiao Xuezhang, Deng Tao, Chen Lixin, Fan Xiulin. (2024) Molecular-docking electrolytes enable high-voltage lithium battery chemistries. Nature Chemistry, (1-9).
4. Yingpeng Gu, Yue Sun. (2024) Quaternary phosphonium strong based anion exchangers for the selective adsorption of nitrate. CHEMICAL ENGINEERING JOURNAL, 485 (149650).

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