Cas no 153209-96-2 (Carbamic acid,[(3-methyl-3-oxetanyl)methyl]-, ethyl ester (9CI))
![Carbamic acid,[(3-methyl-3-oxetanyl)methyl]-, ethyl ester (9CI) structure](https://ossimg.kuujia.com/scimg/153500/153209-96-2x500.png)
153209-96-2 structure
Product Name:Carbamic acid,[(3-methyl-3-oxetanyl)methyl]-, ethyl ester (9CI)
CAS No:153209-96-2
MF:C8H15NO3
MW:173.209602594376
CID:98995
PubChem ID:45122947
Update Time:2025-04-18
Carbamic acid,[(3-methyl-3-oxetanyl)methyl]-, ethyl ester (9CI) Chemical and Physical Properties
Names and Identifiers
-
- Carbamic acid,[(3-methyl-3-oxetanyl)methyl]-, ethyl ester (9CI)
- Carbamic acid, [(3-methyl-3-oxetanyl)methyl]-, ethyl ester (9CI)
- AKOS017401197
- Ethyl ((3-methyloxetan-3-yl)methyl)carbamate
- Carbamic acid,[(3-methyl-3-oxetanyl)methyl]-,ethyl ester(9ci)
- 153209-96-2
- ethyl N-[(3-methyloxetan-3-yl)methyl]carbamate
-
- Inchi： 1S/C8H15NO3/c1-3-12-7(10)9-4-8(2)5-11-6-8/h3-6H2,1-2H3,(H,9,10)
- InChI Key： GDBRRLSFGRBCQB-UHFFFAOYSA-N
- SMILES： O1CC(C)(CNC(=O)OCC)C1
Computed Properties
- Exact Mass: 173.10525
- Monoisotopic Mass: 173.105
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 12
- Rotatable Bond Count: 4
- Complexity: 166
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 0.6
- Topological Polar Surface Area: 47.6A^2
Experimental Properties
- PSA: 47.56
Carbamic acid,[(3-methyl-3-oxetanyl)methyl]-, ethyl ester (9CI) Related Literature
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Li-Hua Gan,Rui Wu,Jian-Lei Tian,Patrick W. Fowler Phys. Chem. Chem. Phys., 2017,19, 419-425
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M. T. Colomer,S. Díaz-Moreno,A. Tamayo,A. L. Ortiz J. Mater. Chem. C, 2018,6, 12643-12651
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Sandip Gangadhar Balwe,Yeon Tae Jeong Org. Biomol. Chem., 2018,16, 1287-1296
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Xin Fu,Qing-rong Liang,Rong-guang Luo,Yan-shu Li,Xiao-ping Xiao,Lu-lu Yu,Wen-zhe Shan,Guang-qin Fan J. Mater. Chem. B, 2019,7, 3088-3099
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