(4-Bromo-3-methylphenyl)(cyclopropyl)methanone - CAS 1267167-02-1
Catalog: |
BB071349 |
Product Name: |
(4-Bromo-3-methylphenyl)(cyclopropyl)methanone |
CAS: |
1267167-02-1 |
Synonyms: |
(4-Bromo-3-methylphenyl)(cyclopropyl)methanone; (4-bromo-3-methylphenyl)-cyclopropylmethanone |
IUPAC Name: | (4-bromo-3-methylphenyl)-cyclopropylmethanone |
Description: | (4-Bromo-3-methylphenyl)(cyclopropyl)methanone |
Molecular Weight: | 239.11 |
Molecular Formula: | C11H11BrO |
Canonical SMILES: | CC1=C(C=CC(=C1)C(=O)C2CC2)Br |
InChI: | InChI=1S/C11H11BrO/c1-7-6-9(4-5-10(7)12)11(13)8-2-3-8/h4-6,8H,2-3H2,1H3 |
InChI Key: | XJPNKCPSLVJPCM-UHFFFAOYSA-N |
Complexity: | 210 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 237.99933 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 237.99933 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 17.1Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.1 |
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