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1-Chloro-2,2-dimethylpropane - >96.0%(GC), high purity , CAS No.753-89-9

COA

Grade & Purity:

≥96%(GC)

Cas Number: 753-89-9
Molecular Weight: 106.59
Beilstein Registry Number: 1(4)336
MDL number: MFCD00000941
PubChem CID: 12956

In stock

Item Number

C153544

Grouped product items
SKU	Size	Availability	Price
C153544-1ml	1ml	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$16.90
C153544-5ml	5ml	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$55.90
C153544-25ml	25ml	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$179.90
C153544-100ml	100ml	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$469.90

View related series

Haloalkane (186) Non heterocyclic block (8163)

Basic Description

Synonyms	Neopentyl chloride \| MFCD00000941 \| F8882-4704 \| SY048171 \| SCHEMBL172298 \| DTXSID7061069 \| AMY1168 \| D89303 \| AKOS009158972 \| EN300-673983 \| EINECS 212-040-8 \| t-C4H9CH2Cl \| Propane, 1-chloro-2,2-dimethyl- \| 1-Chloro-2,2-dimethylpropane \| 1-chloro-2,2-di
Specifications & Purity	≥96%(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

IUPAC Name	1-chloro-2,2-dimethylpropane
INCHI	InChI=1S/C5H11Cl/c1-5(2,3)4-6/h4H2,1-3H3
InChIKey	JEKYMVBQWWZVHO-UHFFFAOYSA-N
Smiles	CC(C)(C)CCl
Isomeric SMILES	CC(C)(C)CCl
WGK Germany	2
Molecular Weight	106.59
Beilstein	1(4)336
Reaxy-Rn	1730985
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1730985&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.

3 results found

Lot Number	Certificate Type	Date	Item
H2419540	Certificate of Analysis	Apr 15, 2024	C153544
H2419539	Certificate of Analysis	Apr 15, 2024	C153544
J2423448	Certificate of Analysis	Apr 15, 2024	C153544

Chemical and Physical Properties

Refractive Index	1.4
Flash Point(°F)	15.8 °F
Flash Point(°C)	-9 °C
Boil Point(°C)	85 °C
Melt Point(°C)	−20 °C(lit.)
Molecular Weight	106.590 g/mol
XLogP3	2.500
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	0
Rotatable Bond Count	1
Exact Mass	106.055 Da
Monoisotopic Mass	106.055 Da
Topological Polar Surface Area	0.000 Å²
Heavy Atom Count	6
Formal Charge	0
Complexity	33.700
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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