3536-54-7
Product Name:
SABINYL ACETATE
Formula:
C12H18O2
Synonyms:
(1S,3R,5S)-1-Isopropyl-4-methylenebicyclo[3.1.0]hex-3-yl acetate;(1S,3R,5S)-4-Methylene-1-(1-methylethyl)bicyclo[3.1.0]hexan-3-ol 3-acetate;cis-Sabinyl acetate;Sabinyl acetate
Inquiry
CHEMICAL AND PHYSICAL PROPERTIES
| Kovats Retention Index | 1301 1266 1263 1287 1285 1289 1276 1287 1289 1277 1262 |
|---|
COMPUTED DESCRIPTORS
| Molecular Weight | 194.27 g/mol |
|---|---|
| XLogP3 | 2.4 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 3 |
| Exact Mass | 194.130679813 g/mol |
| Monoisotopic Mass | 194.130679813 g/mol |
| Topological Polar Surface Area | 26.3 Ų |
| Heavy Atom Count | 14 |
| Formal Charge | 0 |
| Complexity | 293 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 3 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |
PRODUCT INTRODUCTION
description
Sabinyl acetate is a natural product found in Curcuma amada, Stoebe vulgaris, and other organisms with data available.