≥97%(GC) for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
Argon charged,Room temperature Ships Normal Check lot-specific COA for exact specifications.
SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.
Cited in 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.
| Pubchem Sid | 488183544 |
|---|---|
| Pubchem Sid Url | https://pubchem.ncbi.nlm.nih.gov/substance/488183544 |
| 정식 스마일 | CC1CCC(C(=O)C1)C(C)(C)S |
| IUPAC Name | 5-methyl-2-(2-sulfanylpropan-2-yl)cyclohexan-1-one |
| InChIKey | RVOKNSFEAOYULQ-UHFFFAOYSA-N |
| INCHI | 1S/C10H18OS/c1-7-4-5-8(9(11)6-7)10(2,3)12/h7-8,12H,4-6H2,1-3H3 |
| 이성체 SMILES | CC1CCC(C(=O)C1)C(C)(C)S |
| 분자량 | 186.31 |
| Reaxy-Rn | 2206934 |
| Reaxys-RN_link_address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2206934&ln= |
Comprehensive hazard, handling, storage, and regulatory compliance document.
Download SDS →Lot-specific quality data. Enter your lot number to retrieve the exact COA.
Look up COA →Full quality attributes and acceptance criteria for this grade.
View spec sheet →Taxonomy Tree
| Kingdom | Organic compounds |
|---|---|
| Superclass | Lipids and lipid-like molecules |
| 분류 | Prenol lipids |
| Subclass | Monoterpenoids |
| Intermediate Tree Nodes | Not available |
| Direct Parent | Menthane monoterpenoids |
| Alternative Parents | Monocyclic monoterpenoids Cyclic ketones Alkylthiols Organic oxides Hydrocarbon derivatives |
| Molecular Framework | Aliphatic homomonocyclic compounds |
| Substituents | P-menthane monoterpenoid - Monocyclic monoterpenoid - Cyclic ketone - Ketone - Alkylthiol - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organosulfur compound - Organooxygen compound - Carbonyl group - Aliphatic homomonocyclic compound |
| 설명 | This compound belongs to the class of organic compounds known as menthane monoterpenoids. These are monoterpenoids with a structure based on the o-, m-, or p-menthane backbone. P-menthane consists of the cyclohexane ring with a methyl group and a (2-methyl)-propyl group at the 1 and 4 ring position, respectively. The o- and m- menthanes are much rarer, and presumably arise by alkyl migration of p-menthanes. |
| External Descriptors | Not available |
Find and download the COA for your product by matching the lot number on the packaging.
| Lot Number | Certificate Type | 날짜 | 항목 |
|---|---|---|---|
 H2416389 | Certificate of Analysis | Jul 04, 2024 | M158014 |
| H2416390 | Certificate of Analysis | Jul 04, 2024 | M158014 |
| A22071003 | Certificate of Analysis | Dec 04, 2021 | M158014 |
| A22071006 | Certificate of Analysis | Dec 04, 2021 | M158014 |
| A2207528 | Certificate of Analysis | Dec 04, 2021 | M158014 |
| A2207529 | Certificate of Analysis | Dec 04, 2021 | M158014 |
| B2323505 | Certificate of Analysis | Dec 04, 2021 | M158014 |
| 감도 | Air Sensitive |
|---|---|
| 굴절률 | 1.50 |
| 특정 회전[α] | -21° (neat) |
| 발화점(°C) | 108°C |
| 끓는점(°C) | 270-272℃ |
| 분자량 | 186.320 g/mol |
| XLogP3 | 2.300 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 1 |
| Exact Mass | 186.108 Da |
| Monoisotopic Mass | 186.108 Da |
| Topological Polar Surface Area | 18.100 Ų |
| Heavy Atom Count | 12 |
| Formal Charge | 0 |
| Complexity | 186.000 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 2 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| The total count of all stereochemical bonds | 0 |
| Covalently-Bonded Unit Count | 1 |
