1-Chloro-2-methylpropene - CAS 513-37-1
Catalog: |
BB027414 |
Product Name: |
1-Chloro-2-methylpropene |
CAS: |
513-37-1 |
Synonyms: |
1-chloro-2-methylprop-1-ene |
IUPAC Name: | 1-chloro-2-methylprop-1-ene |
Description: | 1-Chloro-2-methylpropene (CAS# 513-37-1) is a reagent in the synthesis of pyrrolyl and indolyl diketo acids and esters as nucleotide-competitive non-nucleoside inhibitors of terminal deoxynucleotidyl transferase. |
Molecular Weight: | 90.55 |
Molecular Formula: | C4H7Cl |
Canonical SMILES: | CC(=CCl)C |
InChI: | InChI=1S/C4H7Cl/c1-4(2)3-5/h3H,1-2H3 |
InChI Key: | KWISWUFGPUHDRY-UHFFFAOYSA-N |
Boiling Point: | 68.1 °C at 760 mmHg |
Flash Point: | 30 °F |
Purity: | 95 % |
Density: | 0.92 g/cm3 |
Solubility: | 1 to 5 mg/mL at 68 °F |
Appearance: | Clear dark yellow to pale orange liquid. |
Decomposition: | When heated to decomposition /temperature unspecified/ , Dimethylvinyl chloride emits highly toxic fumes of hydrochloric acid and other chlorinated compounds |
MDL: | MFCD00000924 |
LogP: | 2.14890 |
Vapor Pressure: | 172.4 mmHg at 77.9 °F ; 265.3 mmHg at 97 °F |
GHS Hazard Statement: | H301: Toxic if swallowed [Danger Acute toxicity, oral] |
Precautionary Statement: | P201, P202, P260, P261, P264, P270, P271, P281, P284, P301+P310, P304+P340, P308+P313, P310, P312, P314, P320, P321, P330, P403+P233, P405, and P501 |
Signal Word: | Danger |
Publication Number | Title | Priority Date |
CN-112808039-A | Non-premixing vortex type gas mixing device | 20210223 |
CN-112565765-A | Multi-point video hierarchical coding and decoding method and transmission device | 20201211 |
CN-111372081-A | Method and device for distributed multi-view video decoding based on lost block repair | 20200317 |
CN-111212286-A | Distributed multi-view video transmission method and system based on layer repair | 20200114 |
US-11033870-B1 | Generators for 1-methylcyclopropene release from carrier complex | 20191116 |
PMID | Publication Date | Title | Journal |
21860474 | 20110101 | Dimethylvinyl chloride | Report on carcinogens : carcinogen profiles |
19786060 | 20100101 | Application of the margin of exposure (MoE) approach to substances in food that are genotoxic and carcinogenic - example: 1-methylcyclopropene and its impurities (1-chloro-2-methylpropene and 3-chloro-2-methylpropene) | Food and chemical toxicology : an international journal published for the British Industrial Biological Research Association |
21089870 | 20040101 | Dimethylvinyl chloride | Report on carcinogens : carcinogen profiles |
15323052 | 20020101 | Dimethylvinyl chloride | Report on carcinogens : carcinogen profiles |
11397402 | 20010601 | Point mutations of K-ras and H-ras genes in forestomach neoplasms from control B6C3F1 mice and following exposure to 1,3-butadiene, isoprene or chloroprene for up to 2-years | Chemico-biological interactions |
Complexity: | 41.6 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 90.0236279 |
Formal Charge: | 0 |
Heavy Atom Count: | 5 |
Hydrogen Bond Acceptor Count: | 0 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 90.0236279 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 0 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.3 |
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