Cas no 65871-38-7 (1-bromo isooctane)
1-bromo isooctane structure
Product Name:1-bromo isooctane
CAS No:65871-38-7
MF:C8H17Br
MW:193.124582052231
CID:962717
PubChem ID:104270
Update Time:2025-04-19
1-bromo isooctane Chemical and Physical Properties
Names and Identifiers
-
- 1-bromo isooctane
- DTXSID6068779
- SCHEMBL3180801
- DA-29605
- 1-Bromo-6-methylheptane
- i-octylbromide
- MFCD00049139
- EN300-19884
- 52648-04-1
- SY162885
- 6-Methylheptyl bromide
- AKOS009031589
- Heptane, 1-bromo-6-methyl-
- 1-Bromoisooctane
- AM806997
- 65871-38-7
- isooctylbromid
- G29482
-
- Inchi： 1S/C8H17Br/c1-8(2)6-4-3-5-7-9/h8H,3-7H2,1-2H3
- InChI Key： BFYPQDKZLOZOLQ-UHFFFAOYSA-N
- SMILES： BrCCCCCC(C)C
Computed Properties
- Exact Mass: 192.05136g/mol
- Monoisotopic Mass: 192.05136g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 0
- Heavy Atom Count: 9
- Rotatable Bond Count: 5
- Complexity: 50.5
- 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: 4.6
- Topological Polar Surface Area: 0?2
1-bromo isooctane Related Literature
-
Liao Xiaoqing,Li Ruiyi,Li Zaijun,Sun Xiulan,Wang Zhouping,Liu Junkang New J. Chem., 2015,39, 5240-5248
-
Ana G. Neo,Ana Bornadiego,Jesús Díaz,Stefano Marcaccini,Carlos F. Marcos Org. Biomol. Chem., 2013,11, 6546-6555
-
Jason Wan Lab Chip, 2020,20, 4528-4538
-
Kay S. McMillan,Anthony G. McCluskey,Annette Sorensen,Marie Boyd,Michele Zagnoni Analyst, 2016,141, 100-110
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