Cas no 92025-35-9 (Ethanone, 1-(3-bromo-1-azulenyl)-)
92025-35-9 structure
Product Name:Ethanone, 1-(3-bromo-1-azulenyl)-
CAS No:92025-35-9
MF:C12H9BrO
MW:249.103262662888
CID:759033
PubChem ID:9942938
Update Time:2025-04-19
Ethanone, 1-(3-bromo-1-azulenyl)- Chemical and Physical Properties
Names and Identifiers
-
- Ethanone, 1-(3-bromo-1-azulenyl)-
- 1-(3-bromoazulen-1-yl)ethanone
- DTXSID60433153
- 92025-35-9
-
- Inchi： 1S/C12H9BrO/c1-8(14)11-7-12(13)10-6-4-2-3-5-9(10)11/h2-7H,1H3
- InChI Key： BMZNJYNWCPSPPE-UHFFFAOYSA-N
- SMILES： BrC1=CC(C(C)=O)=C2C=CC=CC=C21
Computed Properties
- Exact Mass: 247.98368g/mol
- Monoisotopic Mass: 247.98368g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 14
- Rotatable Bond Count: 1
- Complexity: 226
- 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: 3.6
- Topological Polar Surface Area: 17.1?2
Ethanone, 1-(3-bromo-1-azulenyl)- Related Literature
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Ivor Lon?ari? Phys. Chem. Chem. Phys., 2015,17, 9436-9445
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Ross Harder,David C. Dunand,Ian McNulty Nanoscale, 2017,9, 5686-5693
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Long Deng,Qian Zou,Biao Liu,Wenhui Ye,Chengfei Zhuo,Li Chen,Ze-Yuan Deng,Ya-Wei Fan,Jing Li Food Funct., 2018,9, 4234-4245
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Christopher J. Harrison,Kyle J. Berean,Enrico Della Gaspera,Jian Zhen Ou,Richard B. Kaner,Kourosh Kalantar-zadeh,Torben Daeneke Nanoscale, 2016,8, 16276-16283
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Albertus D. Handoko,Khoong Hong Khoo,Teck Leong Tan,Hongmei Jin,Zhi Wei Seh J. Mater. Chem. A, 2018,6, 21885-21890
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