1-Chloro-2-methylbutane - CAS 616-13-7
Catalog: |
BB031194 |
Product Name: |
1-Chloro-2-methylbutane |
CAS: |
616-13-7 |
Synonyms: |
1-chloro-2-methylbutane |
IUPAC Name: | 1-chloro-2-methylbutane |
Description: | 1-Chloro-2-methylbutane (CAS# 616-13-7) is a pesticide that is found in baked potatoes when tested through gas chromatography. |
Molecular Weight: | 106.59 |
Molecular Formula: | C5H11Cl |
Canonical SMILES: | CCC(C)CCl |
InChI: | InChI=1S/C5H11Cl/c1-3-5(2)4-6/h5H,3-4H2,1-2H3 |
InChI Key: | IWAKWOFEHSYKSI-UHFFFAOYSA-N |
Boiling Point: | 100 ℃ (750 mmHg) |
Melting Point: | -104 ℃ |
Purity: | 95 % |
Density: | 0.886 g/cm3 |
LogP: | 2.27130 |
GHS Hazard Statement: | H225 (100%): Highly Flammable liquid and vapor [Danger Flammable liquids] |
Precautionary Statement: | P210, P233, P240, P241, P242, P243, P280, P303+P361+P353, P370+P378, P403+P235, and P501 |
Signal Word: | Danger |
Publication Number | Title | Priority Date |
CN-112679515-A | Benzofuran derivative and preparation method and application thereof | 20201230 |
KR-20210036251-A | Method for forming thin film | 20200728 |
EP-3901125-A1 | Processes for preparing 2-isopropenyl-5-methyl-4-hexenoic acid, 2-isopropenyl-5-methyl-4-hexen-1-ol, and a carboxylate ester thereof | 20200421 |
US-2021323902-A1 | Processes for preparing 2-isopropenyl-5-methyl-4-hexenoic acid, 2-isopropenyl-5-methyl-4-hexen-1-ol, and a carboxylate ester thereof | 20200421 |
KR-102141547-B1 | Method for forming thin film | 20190925 |
Complexity: | 27.1 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 106.0549280 |
Formal Charge: | 0 |
Heavy Atom Count: | 6 |
Hydrogen Bond Acceptor Count: | 0 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 106.0549280 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 0 Å2 |
Undefined Atom Stereocenter Count: | 1 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.5 |
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