Cas no 344330-65-0 (2-Hexanone, 4-hydroxy-3,5-dimethyl- (9CI))
344330-65-0 structure
Product Name:2-Hexanone, 4-hydroxy-3,5-dimethyl- (9CI)
CAS No:344330-65-0
MF:C8H16O2
MW:144.211442947388
CID:1019099
PubChem ID:13172580
Update Time:2025-04-20
2-Hexanone, 4-hydroxy-3,5-dimethyl- (9CI) Chemical and Physical Properties
Names and Identifiers
-
- 2-Hexanone, 4-hydroxy-3,5-dimethyl- (9CI)
- DB-270324
- 2-HEXANONE, 4-HYDROXY-3,5-DIMETHYL-
- SCHEMBL4607962
- 344330-65-0
-
- Inchi： 1S/C8H16O2/c1-5(2)8(10)6(3)7(4)9/h5-6,8,10H,1-4H3
- InChI Key： BNHMGUBZKOAJCU-UHFFFAOYSA-N
- SMILES： OC(C(C(C)=O)C)C(C)C
Computed Properties
- Exact Mass: 144.115029749g/mol
- Monoisotopic Mass: 144.115029749g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 10
- Rotatable Bond Count: 3
- Complexity: 118
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 2
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 1.2
- Topological Polar Surface Area: 37.3?2
2-Hexanone, 4-hydroxy-3,5-dimethyl- (9CI) Related Literature
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Hyejin Moon,Aaron R. Wheeler,Robin L. Garrell,Chang-Jin “CJ” Kim Lab Chip, 2006,6, 1213-1219
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Huifang Yang,Haoran Guo,Peidong Fan,Xinpan Li,Wenlu Ren,Rui Song Nanoscale, 2020,12, 7024-7034
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Robert J. Meagher,Anson V. Hatch,Ronald F. Renzi,Anup K. Singh Lab Chip, 2008,8, 2046-2053
-
Luke L. Lairson,Warren W. Wakarchuk Chem. Commun., 2007, 365-367
-
Bidou Wang,Xifeng Chen Analyst, 2014,139, 5695-5699
344330-65-0 (2-Hexanone, 4-hydroxy-3,5-dimethyl- (9CI)) Related Products
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