Cas no 787517-91-3 (Bicyclo[2.2.1]heptan-2-one, 1,7,7-trimethyl-, radical ion(1-), (1R)- (9CI))
![Bicyclo[2.2.1]heptan-2-one, 1,7,7-trimethyl-, radical ion(1-), (1R)- (9CI) structure](https://ossimg.kuujia.com/scimg/788000/787517-91-3x500.png)
787517-91-3 structure
Product Name:Bicyclo[2.2.1]heptan-2-one, 1,7,7-trimethyl-, radical ion(1-), (1R)- (9CI)
CAS No:787517-91-3
MF:C10H16O
MW:152.233443260193
CID:554839
Update Time:2023-03-29
Bicyclo[2.2.1]heptan-2-one, 1,7,7-trimethyl-, radical ion(1-), (1R)- (9CI) Chemical and Physical Properties
Names and Identifiers
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- Bicyclo[2.2.1]heptan-2-one,1,7,7-trimethyl-, radical ion(1-), (1R)- (9CI)
- Bicyclo[2.2.1]heptan-2-one, 1,7,7-trimethyl-, radical ion(1-), (1R)- (9CI)
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- Inchi： 1S/C10H16O/c1-9(2)7-4-5-10(9,3)8(11)6-7/h7H,4-6H2,1-3H3
- InChI Key： DSSYKIVIOFKYAU-UHFFFAOYSA-N
- SMILES： C12C(C)(C)C(C)(CC1)C(=O)C2
Computed Properties
- Exact Mass: 152.12
- Monoisotopic Mass: 152.12
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 11
- Rotatable Bond Count: 0
- Complexity: 217
- 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
- Topological Polar Surface Area: 17.1A^2
Experimental Properties
- Color/Form: The colorless or white crystalline powder has a strong smell like camphor pills
- Density: 0.992
- Melting Point: 175 °C
- Boiling Point: 345° F (NIOSH, 2016)
- Flash Point: 150° F (NIOSH, 2016)
- Refractive Index: 1.485
- PSA: 17.07000
- LogP: 2.40170
Bicyclo[2.2.1]heptan-2-one, 1,7,7-trimethyl-, radical ion(1-), (1R)- (9CI) Security Information
- Storage Condition：The warehouse is ventilated and dry at low temperature, and stored separately from oxidants and acids
Bicyclo[2.2.1]heptan-2-one, 1,7,7-trimethyl-, radical ion(1-), (1R)- (9CI) Related Literature
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Cheng Fang,Jinjian Wu,Zahra Sobhani,Md. Al Amin,Youhong Tang Anal. Methods, 2019,11, 163-170
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Xin Li,Liangliang Zhu,Sai Duan,Yanli Zhao,Hans ?gren Phys. Chem. Chem. Phys., 2014,16, 23854-23860
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Xiaofeng Lin RSC Adv., 2016,6, 9002-9006
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James D. Kirkham,Patrick M. Delaney,George J. Ellames,Eleanor C. Row,Joseph P. A. Harrity Chem. Commun., 2010,46, 5154-5156
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Quan Xiang,Yiqin Chen,Zhiqin Li,Kaixi Bi,Guanhua Zhang,Huigao Duan Nanoscale, 2016,8, 19541-19550
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