Cas no 60537-25-9 (epi-Inositol,6-O-methyl- (9CI))
60537-25-9 structure
Product Name:epi-Inositol,6-O-methyl- (9CI)
CAS No:60537-25-9
MF:C7H14O6
MW:194.182463169098
CID:508600
PubChem ID:6551016
Update Time:2025-04-19
epi-Inositol,6-O-methyl- (9CI) Chemical and Physical Properties
Names and Identifiers
-
- epi-Inositol,6-O-methyl- (9CI)
- 6-methoxycyclohexane-1,2,3,4,5-pentol
- (-)-bornesitol
- (-)-D-Bornesitol
- 1D-1-O-methyl-myo-inositol
- 3-O-METHYL-D-CHIRO-INOSITOL
- 3-O-methyl-myo-inositol
- abietit
- chiro-Inositol, 3-O-methyl-
- CUNEATE LESPEDZA EXTRACT
- D-(-)-bornesitol
- L-bornesitol
- D-1-O-methyl-muco-inositol
- 60537-25-9
- 1-O-methyl-muco-inositol
-
- Inchi： 1S/C7H14O6/c1-13-7-5(11)3(9)2(8)4(10)6(7)12/h2-12H,1H3/t2?,3-,4+,5-,6+,7?
- InChI Key： DSCFFEYYQKSRSV-QQTVYWKESA-N
- SMILES： O(C)C1[C@@H]([C@@H](C([C@@H]([C@@H]1O)O)O)O)O
Computed Properties
- Exact Mass: 194.07902
- Monoisotopic Mass: 194.079
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 5
- Hydrogen Bond Acceptor Count: 6
- Heavy Atom Count: 13
- Rotatable Bond Count: 1
- Complexity: 158
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 4
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: -3.2
- Topological Polar Surface Area: 110?2
Experimental Properties
- PSA: 110.38
- LogP: -3.18050
epi-Inositol,6-O-methyl- (9CI) Related Literature
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Qiaoe Wang,Meiling Lian,Xiaowen Zhu,Xu Chen RSC Adv., 2021,11, 192-197
-
Gaurav J. Shah,Eric P.-Y. Chiou,Ming C. Wu,Chang-Jin “CJ” Kim Lab Chip, 2009,9, 1732-1739
-
Weili Dai,Guangjun Wu,Michael Hunger Chem. Commun., 2015,51, 13779-13782
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J. Matthew Kurley,Phillip W. Halstenberg,Abbey McAlister,Stephen Raiman,Richard T. Mayes RSC Adv., 2019,9, 25602-25608
-
Hongxia Li,Aikifa Raza,Qiaoyu Ge,Jin-You Lu,TieJun Zhang Soft Matter, 2020,16, 6841-6849
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