Cas no 76985-29-0 ((2R)-2-Oxiranyl-6-methyl-5-heptene-2-ol)
76985-29-0 structure
Product Name:(2R)-2-Oxiranyl-6-methyl-5-heptene-2-ol
CAS No:76985-29-0
MF:C10H18O2
MW:170.248723506927
CID:571567
PubChem ID:44144481
Update Time:2024-03-01
(2R)-2-Oxiranyl-6-methyl-5-heptene-2-ol Chemical and Physical Properties
Names and Identifiers
-
- 2-Oxiranemethanol, a-methyl-a-(4-methyl-3-penten-1-yl)-, (aR,2R)-
- 1,2-oxidolinalool
- (2R)-2-Oxiranyl-6-methyl-5-heptene-2-ol
- Oxiranemethanol, alpha-methyl-alpha-(4-methyl-3-pentenyl)-, (R-(R*,R*))-
- (R-(R*,R*))-alpha-methyl-alpha-(4-methyl-3-pentenyl)oxiranemethanol
-
- Inchi： 1S/C10H18O2/c1-8(2)5-4-6-10(3,11)9-7-12-9/h5,9,11H,4,6-7H2,1-3H3/t9?,10-/m1/s1
- InChI Key： BXOURKNXQXLKRK-QVDQXJPCSA-N
- SMILES： O1CC1[C@@](C)(CC/C=C(\C)/C)O
Computed Properties
- Exact Mass: 170.130679813g/mol
- Monoisotopic Mass: 170.130679813g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 12
- Rotatable Bond Count: 4
- Complexity: 182
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 1
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 32.8
- XLogP3: 1.8
(2R)-2-Oxiranyl-6-methyl-5-heptene-2-ol Related Literature
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Christopher B. Rodell,Christopher B. Highley,Minna H. Chen,Neville N. Dusaj,Chao Wang,Lin Han,Jason A. Burdick Soft Matter, 2016,12, 7839-7847
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Albertus D. Handoko,Khoong Hong Khoo,Teck Leong Tan,Hongmei Jin,Zhi Wei Seh J. Mater. Chem. A, 2018,6, 21885-21890
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Guiying Zhang,Maosheng Cheng,Yanni Li,Keliang Liu,Lifeng Cai Chem. Commun., 2013,49, 11086-11088
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Partha Laskar,Christine Dufès Nanoscale Adv., 2021,3, 6007-6026
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Xiaoming Liu,Zachary D. Hood,Wangda Li,Donovan N. Leonard,Arumugam Manthiram,Miaofang Chi J. Mater. Chem. A, 2021,9, 2111-2119
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