Cas no 76535-41-6 (Hentetracontane, 13,17-dimethyl-)
76535-41-6 structure
Product Name:Hentetracontane, 13,17-dimethyl-
CAS No:76535-41-6
MF:C43H88
MW:605.158834457397
CID:537619
PubChem ID:71403503
Update Time:2025-04-19
Hentetracontane, 13,17-dimethyl- Chemical and Physical Properties
Names and Identifiers
-
- Hentetracontane, 13,17-dimethyl-
- 13,17-dimethylhentetracontane
- 76535-41-6
- DTXSID80824408
-
- Inchi： 1S/C43H88/c1-5-7-9-11-13-15-17-18-19-20-21-22-23-24-25-26-27-28-30-32-34-36-39-43(4)41-37-40-42(3)38-35-33-31-29-16-14-12-10-8-6-2/h42-43H,5-41H2,1-4H3
- InChI Key： RLCIWYUQLLPKJJ-UHFFFAOYSA-N
- SMILES： C(C)(CCCCCCCCCCCCCCCCCCCCCCCC)CCCC(C)CCCCCCCCCCCC
Computed Properties
- Exact Mass: 604.68860281g/mol
- Monoisotopic Mass: 604.68860281g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 0
- Heavy Atom Count: 43
- Rotatable Bond Count: 38
- Complexity: 467
- 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: 22.9
- Topological Polar Surface Area: 0?2
Hentetracontane, 13,17-dimethyl- Related Literature
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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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Jacob S. Jordan,Evan R. Williams Analyst, 2021,146, 2617-2625
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Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
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Kay S. McMillan,Anthony G. McCluskey,Annette Sorensen,Marie Boyd,Michele Zagnoni Analyst, 2016,141, 100-110
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Shintaro Takata,Yoshihiro Miura Phys. Chem. Chem. Phys., 2014,16, 24784-24789
76535-41-6 (Hentetracontane, 13,17-dimethyl-) Related Products
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