Cas no 155800-85-4 ((6R*,8S*)-6,8-heptacosanediol)
(6R*,8S*)-6,8-heptacosanediol structure
Product Name:(6R*,8S*)-6,8-heptacosanediol
CAS No:155800-85-4
MF:C27H56O2
MW:412.732349395752
CID:2016347
PubChem ID:10387002
Update Time:2025-04-21
(6R*,8S*)-6,8-heptacosanediol Chemical and Physical Properties
Names and Identifiers
-
- (6R*,8S*)-6,8-heptacosanediol
- heptacosane-6,8-diol
- erythro-6,8-Heptacosanediol
- LMFA05000655
- 6,8-heptacosanediol
- CHEMBL131679
- DTXSID701304969
- 155800-85-4
- rel-(6R,8S)-6,8-Heptacosanediol
-
- Inchi： 1S/C27H56O2/c1-3-5-7-8-9-10-11-12-13-14-15-16-17-18-19-20-22-24-27(29)25-26(28)23-21-6-4-2/h26-29H,3-25H2,1-2H3
- InChI Key： VOOVQMDKNDAOJU-UHFFFAOYSA-N
- SMILES： OC(CC(CCCCC)O)CCCCCCCCCCCCCCCCCCC
Computed Properties
- Exact Mass: 412.42803102g/mol
- Monoisotopic Mass: 412.42803102g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 29
- Rotatable Bond Count: 24
- Complexity: 292
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 2
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 11.6
- Topological Polar Surface Area: 40.5?2
(6R*,8S*)-6,8-heptacosanediol Related Literature
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Teresita Carrillo-Hernández,Philippe Schaeffer,Pierre Albrecht Chem. Commun., 2001, 1976-1977
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Hyejin Moon,Aaron R. Wheeler,Robin L. Garrell,Chang-Jin “CJ” Kim Lab Chip, 2006,6, 1213-1219
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Jingquan Liu,Huiyun Liu,Zhongfan Jia,Volga Bulmus,Thomas P. Davis Chem. Commun., 2008, 6582-6584
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Quan Xiang,Yiqin Chen,Zhiqin Li,Kaixi Bi,Guanhua Zhang,Huigao Duan Nanoscale, 2016,8, 19541-19550
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Inês S. Albuquerque,Hélia F. Jeremias,Miguel Chaves-Ferreira,Dijana Matak-Vinkovic,Omar Boutureira,Carlos C. Rom?o Chem. Commun., 2015,51, 3993-3996
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