Cas no 15585-04-3 (myo-Inositol,1,2,5-O-methylidyne- (9CI))
15585-04-3 structure
Product Name:myo-Inositol,1,2,5-O-methylidyne- (9CI)
CAS No:15585-04-3
MF:C7H10O6
MW:190.150702953339
CID:121077
PubChem ID:55250673
Update Time:2025-04-18
myo-Inositol,1,2,5-O-methylidyne- (9CI) Chemical and Physical Properties
Names and Identifiers
-
- myo-Inositol,1,2,5-O-methylidyne- (9CI)
- INOSITOL MONO ORTHOFORMATE
- (4S,6R)-2,9,10-trioxatricyclo[5.2.1.03,8]decane-4,5,6-triol
- 15585-04-3
- AKOS006278422
-
- Inchi： 1S/C7H10O6/c8-1-2(9)4-6-5(3(1)10)12-7(11-4)13-6/h1-10H/t1?,2-,3+,4?,5?,6?,7?
- InChI Key： KAXHBBXQFNRUAE-XKJLXWSNSA-N
- SMILES： O1C2OC3[C@@H](C([C@@H](C(C13)O2)O)O)O
Computed Properties
- Exact Mass: 190.04800
- Monoisotopic Mass: 190.04773803g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 3
- Hydrogen Bond Acceptor Count: 6
- Heavy Atom Count: 13
- Rotatable Bond Count: 0
- Complexity: 213
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 2
- Undefined Atom Stereocenter Count : 2
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: -2.3
- Topological Polar Surface Area: 88.4?2
Experimental Properties
- PSA: 88.38000
- LogP: -2.45090
myo-Inositol,1,2,5-O-methylidyne- (9CI) Related Literature
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Yaling Zhang,Chunhui Dai,Shiwei Zhou,Bin Liu Chem. Commun., 2018,54, 10092-10095
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Weili Dai,Guangjun Wu,Michael Hunger Chem. Commun., 2015,51, 13779-13782
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David White,Sean R. Stowell Biomater. Sci., 2017,5, 463-474
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Max Attwood,Hiroki Akutsu,Lee Martin,Toby J. Blundell,Pierre Le Maguere,Scott S. Turner Dalton Trans., 2021,50, 11843-11851
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Norihito Fukui,Keisuke Fujimoto,Hideki Yorimitsu,Atsuhiro Osuka Dalton Trans., 2017,46, 13322-13341
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