4-Chloro-3-methylbutanoyl Chloride - CAS 63480-13-7
Catalog: |
BB032166 |
Product Name: |
4-Chloro-3-methylbutanoyl Chloride |
CAS: |
63480-13-7 |
Synonyms: |
4-chloro-3-methylbutanoyl chloride; 4-chloro-3-methylbutanoyl chloride |
IUPAC Name: | 4-chloro-3-methylbutanoyl chloride |
Description: | 4-Chloro-3-methylbutanoyl Chloride (CAS# 63480-13-7 ) is a useful research chemical. |
Molecular Weight: | 155.02 |
Molecular Formula: | C5H8Cl2O |
Canonical SMILES: | CC(CC(=O)Cl)CCl |
InChI: | InChI=1S/C5H8Cl2O/c1-4(3-6)2-5(7)8/h4H,2-3H2,1H3 |
InChI Key: | WPJSMHMSPFVCED-UHFFFAOYSA-N |
LogP: | 2.01680 |
Publication Number | Title | Priority Date |
AU-2005318530-A1 | Cycloalkylamine derivatives | 20041220 |
CA-2590985-A1 | Cycloalkylamine derivatives | 20041220 |
CN-101084184-A | Cycloalkylamine derivatives | 20041220 |
EP-1833782-A1 | Cycloalkylamine derivatives | 20041220 |
EP-1833782-B1 | Cycloalkylamine derivatives | 20041220 |
Complexity: | 82.5 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 153.9952203 |
Formal Charge: | 0 |
Heavy Atom Count: | 8 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 153.9952203 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 17.1 |
Undefined Atom Stereocenter Count: | 1 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.1 |
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