1-(4-Bromophenyl)-2-methylpropan-1-one - CAS 49660-93-7
Catalog: |
BB071292 |
Product Name: |
1-(4-Bromophenyl)-2-methylpropan-1-one |
CAS: |
49660-93-7 |
Synonyms: |
1-(4-Bromophenyl)-2-methylpropan-1-one; 1-(4-Bromophenyl)-2-methyl-1-propanone; 1-(4-Bromo-phenyl)-2-methyl-propan-1-one; 1-Propanone, 1-(4-bromophenyl)-2-methyl-; 4'-Bromo-alpha-methylpropiophenone |
IUPAC Name: | 1-(4-bromophenyl)-2-methylpropan-1-one |
Description: | 1-(4-Bromophenyl)-2-methylpropan-1-one |
Molecular Weight: | 227.1 |
Molecular Formula: | C10H11BrO |
Canonical SMILES: | CC(C)C(=O)C1=CC=C(C=C1)Br |
InChI: | InChI=1S/C10H11BrO/c1-7(2)10(12)8-3-5-9(11)6-4-8/h3-7H,1-2H3 |
InChI Key: | PMFLKZHWZXWOEH-UHFFFAOYSA-N |
GHS Hazard Statement: | H302 (50%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 |
Signal Word: | Warning |
Complexity: | 157 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 225.99933 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 225.99933 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 17.1Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.4 |
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