3-Chloro-1,1-dimethoxy-2-methylpropane - CAS 1081778-33-7
Catalog: |
BB062339 |
Product Name: |
3-Chloro-1,1-dimethoxy-2-methylpropane |
CAS: |
1081778-33-7 |
Synonyms: |
3-chloro-1,1-dimethoxy-2-methylpropane |
IUPAC Name: | 3-chloro-1,1-dimethoxy-2-methylpropane |
Description: | 3-Chloro-1,1-dimethoxy-2-methylpropane is used in the preparation of lysine related compounds. |
Molecular Weight: | 152.62 |
Molecular Formula: | C6H13ClO2 |
Canonical SMILES: | CC(CCl)C(OC)OC |
InChI: | InChI=1S/C6H13ClO2/c1-5(4-7)6(8-2)9-3/h5-6H,4H2,1-3H3 |
InChI Key: | GCUUOZXGWUTXLU-UHFFFAOYSA-N |
References: | Takehara, M., Yoshida, R. Nippon Kagaku Zasshi, 90, 101 (1969). |
Complexity: | 64.1 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 152.0604073 |
Formal Charge: | 0 |
Heavy Atom Count: | 9 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 152.0604073 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 18.5Ų |
Undefined Atom Stereocenter Count: | 1 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.5 |
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