Cas no 59191-78-5 (2-Octanone,3-(hydroxymethyl)-)
2-Octanone,3-(hydroxymethyl)- structure
Product Name:2-Octanone,3-(hydroxymethyl)-
CAS No:59191-78-5
MF:C9H18O2
MW:158.238023281097
CID:372229
Update Time:2026-05-14
2-Octanone,3-(hydroxymethyl)- Chemical and Physical Properties
Names and Identifiers
-
- 2-Octanone,3-(hydroxymethyl)-
- 3-(hydroxymethyl)octan-2-one
- 3-(Hydroxymethyl)-2-octanone
- 3-Hydroxymethyl-2-octanone
- FEMA No. 3292
-
Computed Properties
- Exact Mass: 158.13074
- Monoisotopic Mass: 158.13068
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 11
- Rotatable Bond Count: 6
- Complexity: 110
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 37.3
Experimental Properties
- Density: 0.919
- Boiling Point: 245 oC
- Flash Point: 101 oC
- Refractive Index: 1.442
- PSA: 37.3
- FEMA: 3292 | 3-(HYDROXYMETHYL)-2-OCTANONE
2-Octanone,3-(hydroxymethyl)- Related Literature
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Yaqing Liu,Jiangtao Ren,Jing Li,Jiyang Liu,Erkang Wang Chem. Commun., 2012,48, 802-804
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Siquan Zhang,Shengyao Wang,Liping Guo,Hao Chen,Bien Tan,Shangbin Jin J. Mater. Chem. C, 2020,8, 192-200
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Jianyao Huang,Dong Gao,Zhihui Chen,Weifeng Zhang Polym. Chem., 2021,12, 2471-2480
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Sandip Gangadhar Balwe,Yeon Tae Jeong Org. Biomol. Chem., 2018,16, 1287-1296
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