2-Bromo-1-(2,2-difluoro-1-methylcyclopropyl)ethanone - CAS 128073-31-4
Catalog: |
BB071167 |
Product Name: |
2-Bromo-1-(2,2-difluoro-1-methylcyclopropyl)ethanone |
CAS: |
128073-31-4 |
Synonyms: |
2-bromo-1-(2,2-difluoro-1-methylcyclopropyl)ethanone; Ethanone, 2-bromo-1-(2,2-difluoro-1-methylcyclopropyl)- (9CI); 2-bromo-1-(2,2-difluoro-1-methylcyclopropyl)ethan-1-one |
IUPAC Name: | 2-bromo-1-(2,2-difluoro-1-methylcyclopropyl)ethanone |
Molecular Weight: | 213.02 |
Molecular Formula: | C6H7BrF2O |
Canonical SMILES: | CC1(CC1(F)F)C(=O)CBr |
InChI: | InChI=1S/C6H7BrF2O/c1-5(4(10)2-7)3-6(5,8)9/h2-3H2,1H3 |
InChI Key: | BZRNEASAKFDGKW-UHFFFAOYSA-N |
GHS Hazard Statement: | H227 (100%): Combustible liquid [Warning Flammable liquids] |
Precautionary Statement: | P210, P260, P261, P264, P271, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P319, P321, P363, P370+P378, P403, P403+P233, P405, and P501 |
Signal Word: | Danger |
Complexity: | 181 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 211.96483 |
Formal Charge: | 0 |
Heavy Atom Count: | 10 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 211.96483 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 17.1Ų |
Undefined Atom Stereocenter Count: | 1 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.9 |
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