Cas no 3332-40-9 ([30]Annulene)
![[30]Annulene structure](https://ossimg.kuujia.com/scimg/3500/3332-40-9x500.png)
[30]Annulene structure
Product Name:[30]Annulene
CAS No:3332-40-9
MF:C30H30
MW:390.559208393097
CID:2721396
PubChem ID:57459441
Update Time:2025-04-21
[30]Annulene Chemical and Physical Properties
Names and Identifiers
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- cyclotriacontapentadecaene
- DTXSID30726665
- [30]Annulene
- (1Z,3E,5E,7Z,9E,11E,13E,15E,17Z,19E,21E,23E,25E,27E,29E)-Cyclotriaconta-1,3,5,7,9,11,13,15,17,19,21,23,25,27,29-pentadecaene
- 3332-40-9
-
- Inchi： 1S/C30H30/c1-2-4-6-8-10-12-14-16-18-20-22-24-26-28-30-29-27-25-23-21-19-17-15-13-11-9-7-5-3-1/h1-30H/b2-1-,3-1-,4-2-,5-3+,6-4+,7-5+,8-6+,9-7+,10-8+,11-9-,12-10+,13-11+,14-12+,15-13+,16-14+,17-15+,18-16+,19-17-,20-18+,21-19+,22-20-,23-21+,24-22+,25-23+,26-24+,27-25+,28-26+,29-27-,30-28+,30-29-
- InChI Key： YGAONFZLXDXJSM-SJSUNIARSA-N
- SMILES： C1C=CC=CC=CC=CC=CC=CC=CC=CC=CC=CC=CC=CC=CC=CC=1 |c:11,17,21,25,27,t:1,3,5,7,9,13,15,19,23,29|
Computed Properties
- Exact Mass: 390.234750957Da
- Monoisotopic Mass: 390.234750957Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 0
- Heavy Atom Count: 30
- Rotatable Bond Count: 0
- Complexity: 467
- 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: 11.8
- Topological Polar Surface Area: 0?2
[30]Annulene Related Literature
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M. Zeiger,N. J?ckel,P. Strubel,L. Borchardt,R. Reinhold,W. Nickel,J. Eckert,V. Presser,S. Kaskel J. Mater. Chem. A, 2015,3, 17983-17990
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Maomao Hou,Fenglin Zhong,Qiu Jin,Enjiang Liu,Jie Feng,Tengyun Wang,Yue Gao RSC Adv., 2017,7, 34392-34400
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J. Matthew Kurley,Phillip W. Halstenberg,Abbey McAlister,Stephen Raiman,Richard T. Mayes RSC Adv., 2019,9, 25602-25608
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Partha Laskar,Christine Dufès Nanoscale Adv., 2021,3, 6007-6026
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Xing Zhao,Lu Bai,Rui-Ying Bao,Zheng-Ying Liu,Ming-Bo Yang,Wei Yang RSC Adv., 2017,7, 46297-46305
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