Cas no 59965-20-7 (Octane, 1-bromo-3,7-dimethyl-, (3R)-)
59965-20-7 structure
Product Name:Octane, 1-bromo-3,7-dimethyl-, (3R)-
CAS No:59965-20-7
MF:C10H21Br
MW:221.17774271965
CID:336662
PubChem ID:12801557
Update Time:2025-04-19
Octane, 1-bromo-3,7-dimethyl-, (3R)- Chemical and Physical Properties
Names and Identifiers
-
- Octane, 1-bromo-3,7-dimethyl-, (3R)-
- 59965-20-7
- (R)-(-)-1-bromo-3,7-dimethyloctane
- SCHEMBL6757747
- (R)-1-bromo-3,7-dimethyloctane
- (3R)-1-bromo-3,7-dimethyloctane
- VGSUDZKDSKCYJP-SNVBAGLBSA-N
-
- Inchi： 1S/C10H21Br/c1-9(2)5-4-6-10(3)7-8-11/h9-10H,4-8H2,1-3H3/t10-/m1/s1
- InChI Key： VGSUDZKDSKCYJP-SNVBAGLBSA-N
- SMILES： BrCC[C@H](C)CCCC(C)C
Computed Properties
- Exact Mass: 220.08273
- Monoisotopic Mass: 220.08266g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 0
- Heavy Atom Count: 11
- Rotatable Bond Count: 6
- Complexity: 78.9
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 1
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 5.1
- Topological Polar Surface Area: 0?2
Experimental Properties
- PSA: 0
Octane, 1-bromo-3,7-dimethyl-, (3R)- 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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Guiying Zhang,Maosheng Cheng,Yanni Li,Keliang Liu,Lifeng Cai Chem. Commun., 2013,49, 11086-11088
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Dhirendra K. Chaudhary,Pramendra Kumar,Lokendra Kumar RSC Adv., 2016,6, 94731-94738
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Peiyuan Zeng,Xiaoxiao Wang,Ming Ye,Qiuyang Ma,Jianwen Li,Wanwan Wang,Baoyou Geng,Zhen Fang RSC Adv., 2016,6, 23074-23084
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Thi Thu Tram Nguyen,Thanh Binh Nguyen Org. Biomol. Chem., 2021,19, 6015-6020
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