6-Bromo-3,3-dimethyl-2,3-dihydro-1H-inden-1-one - CAS 67159-84-6
Catalog: |
BB033202 |
Product Name: |
6-Bromo-3,3-dimethyl-2,3-dihydro-1H-inden-1-one |
CAS: |
67159-84-6 |
Synonyms: |
6-bromo-3,3-dimethyl-2H-inden-1-one; 6-bromo-3,3-dimethyl-2H-inden-1-one |
IUPAC Name: | 6-bromo-3,3-dimethyl-2H-inden-1-one |
Description: | 6-Bromo-3,3-dimethyl-2,3-dihydro-1H-inden-1-one (CAS# 67159-84-6) is a useful research chemical. |
Molecular Weight: | 239.11 |
Molecular Formula: | C11H11BrO |
Canonical SMILES: | CC1(CC(=O)C2=C1C=CC(=C2)Br)C |
InChI: | InChI=1S/C11H11BrO/c1-11(2)6-10(13)8-5-7(12)3-4-9(8)11/h3-5H,6H2,1-2H3 |
InChI Key: | YIFWUKQMDXTIFS-UHFFFAOYSA-N |
LogP: | 3.31310 |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
JP-2020089361-A | Quencher and its application | 20181204 |
KR-20200067732-A | Quencher and their applications | 20181204 |
KR-102246542-B1 | Quencher and their applications | 20181204 |
AU-2015263620-B2 | Antidiabetic tricyclic compounds | 20140522 |
EP-3145915-A1 | Antidiabetic tricyclic compounds | 20140522 |
Complexity: | 234 |
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: | 0 |
Topological Polar Surface Area: | 17.1 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.2 |
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