2-Chloro-1-cyclopropyl-4,4-difluorobutane-1,3-dione - CAS 886494-05-9
Catalog: |
BB048598 |
Product Name: |
2-Chloro-1-cyclopropyl-4,4-difluorobutane-1,3-dione |
CAS: |
886494-05-9 |
Synonyms: |
1,3-Butanedione, 2-chloro-1-cyclopropyl-4,4-difluoro-; 2-Chloro-1-cyclopropyl-4,4-difluoro-1,3-butanedione |
IUPAC Name: | 2-chloro-1-cyclopropyl-4,4-difluorobutane-1,3-dione |
Description: | 2-Chloro-1-cyclopropyl-4,4-difluorobutane-1,3-dione (CAS# 886494-05-9 ) is a useful research chemical. |
Molecular Weight: | 196.58 |
Molecular Formula: | C7H7ClF2O2 |
Canonical SMILES: | C1CC1C(=O)C(C(=O)C(F)F)Cl |
InChI: | InChI=1S/C7H7ClF2O2/c8-4(6(12)7(9)10)5(11)3-1-2-3/h3-4,7H,1-2H2 |
InChI Key: | MGVKPOLBFKCZCT-UHFFFAOYSA-N |
Boiling Point: | 231.7±35.0 ℃ at 760 mmHg |
Purity: | ≥ 95 % |
Density: | 1.4±0.1 g/cm3 |
Complexity: | 214 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 196.0102635 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 196.0102635 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 34.1 |
Undefined Atom Stereocenter Count: | 1 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.8 |
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