Cas no 30834-51-6 (Spiro[bicyclo[2.2.1]hept-5-ene-2,1'-[2]cyclohexen]-4'-one)
![Spiro[bicyclo[2.2.1]hept-5-ene-2,1'-[2]cyclohexen]-4'-one structure](https://ossimg.kuujia.com/scimg/31000/30834-51-6x500.png)
30834-51-6 structure
Product Name:Spiro[bicyclo[2.2.1]hept-5-ene-2,1'-[2]cyclohexen]-4'-one
CAS No:30834-51-6
MF:C12H14O
MW:174.238963603973
CID:316934
PubChem ID:141591
Update Time:2025-04-19
Spiro[bicyclo[2.2.1]hept-5-ene-2,1'-[2]cyclohexen]-4'-one Chemical and Physical Properties
Names and Identifiers
-
- Spiro[bicyclo[2.2.1]hept-5-ene-2,1'-[2]cyclohexen]-4'-one
- spiro[bicyclo[2.2.1]hept-2-ene-5,4'-cyclohex-2-ene]-1'-one
- 30834-51-6
- spiro[bicyclo[2.2.1]heptane-2,1'-cyclohexane]-2',5-dien-4'-one
- DTXSID20953044
- Spiro-2-cyclohexene-4-one-1,2'-(5-norbornene)
-
- Inchi： 1S/C12H14O/c13-11-3-5-12(6-4-11)8-9-1-2-10(12)7-9/h1-3,5,9-10H,4,6-8H2
- InChI Key： ZANBBQSNIRIMCX-UHFFFAOYSA-N
- SMILES： O=C1C=CC2(CC1)CC1C=CC2C1
Computed Properties
- Exact Mass: 174.10452
- Monoisotopic Mass: 174.104
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 13
- Rotatable Bond Count: 0
- Complexity: 313
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 3
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 2.3
- Topological Polar Surface Area: 17.1?2
Experimental Properties
- Density: 1.11
- Boiling Point: 307°Cat760mmHg
- Flash Point: 122.6°C
- Refractive Index: 1.573
- PSA: 17.07
Spiro[bicyclo[2.2.1]hept-5-ene-2,1'-[2]cyclohexen]-4'-one Related Literature
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Helga Garcia,Rui Ferreira,Marija Petkovic,Jamie L. Ferguson,Maria C. Leit?o,H. Q. Nimal Gunaratne,Luís Paulo N. Rebelo Green Chem., 2010,12, 367-369
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Gang Pan,Yi-jie Bao,Jie Xu,Tao Liu,Cheng Liu,Yan-yan Qiu,Xiao-jing Shi,Hui Yu,Ting-ting Jia,Xia Yuan,Ze-ting Yuan,Yi-jun Cao RSC Adv., 2016,6, 42109-42119
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Yukiya Kitayama Polym. Chem., 2014,5, 2784-2792
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Qiyuan Wu,Shangmin Xiong,Peichuan Shen,Shen Zhao,Alexander Orlov Catal. Sci. Technol., 2015,5, 2059-2064
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Partha Laskar,Christine Dufès Nanoscale Adv., 2021,3, 6007-6026
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