Cas no 6366-35-4 (1-chloro-2,2-dimethylbutane)

1-Chloro-2,2-dimethylbutane is a halogenated hydrocarbon with the molecular formula C6H13Cl. This compound is characterized by its branched alkyl structure, featuring a chlorine substituent at the primary carbon and two methyl groups at the adjacent carbon. It serves as a versatile intermediate in organic synthesis, particularly in alkylation and nucleophilic substitution reactions. Its sterically hindered structure can influence reaction pathways, offering selectivity advantages in certain transformations. The compound is typically a clear, volatile liquid with moderate stability under standard conditions. It finds utility in pharmaceutical and agrochemical research as a building block for more complex molecules. Proper handling requires consideration of its flammability and potential reactivity with strong bases or oxidizers.
1-chloro-2,2-dimethylbutane structure
1-chloro-2,2-dimethylbutane structure
Product Name:1-chloro-2,2-dimethylbutane
CAS No:6366-35-4
MF:C6H13Cl
MW:120.620421171188
CID:1667264
PubChem ID:524244
Update Time:2025-05-27

1-chloro-2,2-dimethylbutane Chemical and Physical Properties

Names and Identifiers

    • 1-chloro-2,2-dimethylbutane
    • 6366-35-4
    • Butane, 1-chloro-2,2-dimethyl
    • EN300-114770
    • AKOS011971806
    • SCHEMBL681665
    • DTXSID80979886
    • Inchi： 1S/C6H13Cl/c1-4-6(2,3)5-7/h4-5H2,1-3H3
    • InChI Key： JRUIYWSZTLWHME-UHFFFAOYSA-N
    • SMILES： ClCC(C)(C)CC

Computed Properties

  • Exact Mass: 120.07069
  • Monoisotopic Mass: 120.0705781g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 0
  • Heavy Atom Count: 7
  • Rotatable Bond Count: 2
  • Complexity: 48.1
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 2.9
  • Topological Polar Surface Area: 0?2

Experimental Properties

  • PSA: 0

1-chloro-2,2-dimethylbutane Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
SHANG HAI HAO HONG Biomedical Technology Co., Ltd.
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 ￥6264.00 2024-05-05
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Enamine
EN300-114770-0.25g
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 6366-35-4 95%
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Enamine
EN300-114770-0.5g
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 $397.0 2023-10-25
Enamine
EN300-114770-1.0g
1-chloro-2,2-dimethylbutane
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 $743.0 2023-06-09
Enamine
EN300-114770-2.5g
1-chloro-2,2-dimethylbutane
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2.5g
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Enamine
EN300-114770-5.0g
1-chloro-2,2-dimethylbutane
 6366-35-4
5g
 $2152.0 2023-06-09
Enamine
EN300-114770-10.0g
1-chloro-2,2-dimethylbutane
 6366-35-4
10g
 $3191.0 2023-06-09
Enamine
EN300-114770-1g
1-chloro-2,2-dimethylbutane
 6366-35-4 95%
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