1-Cyclopropyl-4,4-difluorobutane-1,3-dione - CAS 758709-39-6
Catalog: |
BB045514 |
Product Name: |
1-Cyclopropyl-4,4-difluorobutane-1,3-dione |
CAS: |
758709-39-6 |
Synonyms: |
1-cyclopropyl-4,4-difluoro-butane-1,3-dione; 1,3-Butanedione, 1-cyclopropyl-4,4-difluoro- |
IUPAC Name: | 1-cyclopropyl-4,4-difluorobutane-1,3-dione |
Description: | 1-Cyclopropyl-4,4-difluorobutane-1,3-dione (CAS# 758709-39-6 ) is a useful research chemical. |
Molecular Weight: | 162.13 |
Molecular Formula: | C7H8F2O2 |
Canonical SMILES: | C1CC1C(=O)CC(=O)C(F)F |
InChI: | InChI=1S/C7H8F2O2/c8-7(9)6(11)3-5(10)4-1-2-4/h4,7H,1-3H2 |
InChI Key: | UOFKQNOBCDNGOW-UHFFFAOYSA-N |
GHS Hazard Statement: | H227 (100%): Combustible liquid [Warning Flammable liquids]; H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]; H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]; H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation] |
Precautionary Statement: | P210, P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P370+P378, P403, P403+P233, P405, and P501 |
Signal Word: | Warning |
Complexity: | 185 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 162.04923582 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 162.04923582 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 34.1 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.1 |
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