Cas no 80270-88-8 (2(1H)-Naphthalenone, 3,4-dihydro-5,8-dimethyl-)
80270-88-8 structure
Product Name:2(1H)-Naphthalenone, 3,4-dihydro-5,8-dimethyl-
CAS No:80270-88-8
MF:C12H14O
MW:174.238963603973
CID:705968
PubChem ID:11052152
Update Time:2025-04-19
2(1H)-Naphthalenone, 3,4-dihydro-5,8-dimethyl- Chemical and Physical Properties
Names and Identifiers
-
- 2(1H)-Naphthalenone, 3,4-dihydro-5,8-dimethyl-
- 5,8-dimethyl-3,4-dihydro-1H-naphthalen-2-one
- 80270-88-8
- DTXSID50453380
-
- Inchi： 1S/C12H14O/c1-8-3-4-9(2)12-7-10(13)5-6-11(8)12/h3-4H,5-7H2,1-2H3
- InChI Key： UMWLDCUIKHNULS-UHFFFAOYSA-N
- SMILES： O=C1CCC2C(C)=CC=C(C)C=2C1
Computed Properties
- Exact Mass: 174.104465066g/mol
- Monoisotopic Mass: 174.104465066g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 13
- Rotatable Bond Count: 0
- Complexity: 209
- 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: 2.3
- Topological Polar Surface Area: 17.1?2
2(1H)-Naphthalenone, 3,4-dihydro-5,8-dimethyl- Related Literature
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Jianyao Huang,Dong Gao,Zhihui Chen,Weifeng Zhang Polym. Chem., 2021,12, 2471-2480
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David B. Cordes,Alexandra M. Z. Slawin,Stefania Righetto,Denis Jacquemin,Eli Zysman-Colman,Véronique Guerchais Dalton Trans., 2018,47, 8292-8300
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Jialiang Yuan,Ran Dong,Yuan Li,Yang Liu,Zhuo Zheng,Yuxia Liu,Yan Sun,Benhe Zhong,Zhenguo Wu,Xiaodong Guo Chem. Commun., 2021,57, 13004-13007
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Alvin Tanudjaja,Shinsuke Inagi,Fusao Kitamura,Toshikazu Takata,Ikuyoshi Tomita Dalton Trans., 2021,50, 3037-3043
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Robert J. Meagher,Anson V. Hatch,Ronald F. Renzi,Anup K. Singh Lab Chip, 2008,8, 2046-2053
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