Cas no 55475-50-8 ((8R)-7-but-3-en-1-yl-2-pent-4-en-1-yl-1-azaspiro[5.5]undecan-8-ol)
![(8R)-7-but-3-en-1-yl-2-pent-4-en-1-yl-1-azaspiro[5.5]undecan-8-ol structure](https://ossimg.kuujia.com/scimg/55500/55475-50-8x500.png)
55475-50-8 structure
Product Name:(8R)-7-but-3-en-1-yl-2-pent-4-en-1-yl-1-azaspiro[5.5]undecan-8-ol
CAS No:55475-50-8
MF:C19H33NO
MW:291.471425771713
CID:1593689
PubChem ID:6453188
Update Time:2025-04-21
(8R)-7-but-3-en-1-yl-2-pent-4-en-1-yl-1-azaspiro[5.5]undecan-8-ol Chemical and Physical Properties
Names and Identifiers
-
- (8R)-7-but-3-en-1-yl-2-pent-4-en-1-yl-1-azaspiro[5.5]undecan-8-ol
- (10R)-11-but-3-enyl-2-pent-4-enyl-1-azaspiro[5.5]undecan-10-ol
- Octahydrohistrionicotoxin
- 55475-50-8
- 7-(But-3-en-1-yl)-2-(pent-4-en-1-yl)-1-azaspiro[5.5]undecan-8-ol
- DTXSID50970820
- 1-Azaspiro(5.5)undecan-8-ol, 7-(3-butenyl)-2-(4-pentenyl)-, (6R-(6alpha(R*),7beta,8alpha))-
-
- Inchi： 1S/C19H33NO/c1-3-5-7-10-16-11-8-14-19(20-16)15-9-13-18(21)17(19)12-6-4-2/h3-4,16-18,20-21H,1-2,5-15H2/t16?,17?,18-,19?/m1/s1
- InChI Key： QVOJHZPSXNUASC-YKPIGIGISA-N
- SMILES： O[C@@H]1CCCC2(CCCC(CCCC=C)N2)C1CCC=C
Computed Properties
- Exact Mass: 291.25639
- Monoisotopic Mass: 291.256215
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 21
- Rotatable Bond Count: 7
- Complexity: 341
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 1
- Undefined Atom Stereocenter Count : 3
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 32.3
- XLogP3: 4.4
Experimental Properties
- Density: 0.96
- Boiling Point: 406.5°C at 760 mmHg
- Flash Point: 58.6°C
- Refractive Index: 1.512
- PSA: 32.26
(8R)-7-but-3-en-1-yl-2-pent-4-en-1-yl-1-azaspiro[5.5]undecan-8-ol Related Literature
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Ivor Lon?ari? Phys. Chem. Chem. Phys., 2015,17, 9436-9445
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Amandine Altmayer-Henzien,Valérie Declerck,David J. Aitken,Ewen Lescop,Denis Merlet,Jonathan Farjon Org. Biomol. Chem., 2013,11, 7611-7615
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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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Jason Y. C. Lim,Yong Yu,Guorui Jin,Kai Li,Yi Lu,Jianping Xie Nanoscale Adv., 2020,2, 3921-3932
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Sowmyalakshmi Venkataraman RSC Adv., 2015,5, 73807-73813
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