Cas no 100594-88-5 (Pyrrolidine,2-(5-hexen-1-yl)-5-nonyl-)
100594-88-5 structure
Product Name:Pyrrolidine,2-(5-hexen-1-yl)-5-nonyl-
CAS No:100594-88-5
MF:C19H37N
MW:279.503785848618
CID:167224
PubChem ID:180891
Update Time:2025-04-19
Pyrrolidine,2-(5-hexen-1-yl)-5-nonyl- Chemical and Physical Properties
Names and Identifiers
-
- Pyrrolidine,2-(5-hexen-1-yl)-5-nonyl-
- Pyrrolidine,2-(5-hexenyl)-5-nonyl- (9CI)
- 2-hex-5-enyl-5-nonylpyrrolidine
- 2-(5-hexenyl)-5-nonylpyrrolidine
- 2-(HEX-5-EN-1-YL)-5-NONYLPYRROLIDINE
- 2-(1-hex-5-enyl)-5-nonylpyrrolidine
- 100594-88-5
- PD180476
- 2-hex-5-enyl-5-nonyl-pyrrolidine
- Pyrrolidine, 2-(5-hexenyl)-5-nonyl-
- BDBM50284429
- DTXSID90905611
- CHEMBL417618
-
- Inchi： 1S/C19H37N/c1-3-5-7-9-10-11-13-15-19-17-16-18(20-19)14-12-8-6-4-2/h4,18-20H,2-3,5-17H2,1H3
- InChI Key： VJYHAIYEEJOCLT-UHFFFAOYSA-N
- SMILES： N1C(CCCCC=C)CCC1CCCCCCCCC
Computed Properties
- Exact Mass: 279.29281
- Monoisotopic Mass: 279.292600184g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 20
- Rotatable Bond Count: 13
- Complexity: 224
- 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: 7.3
- Topological Polar Surface Area: 12?2
Experimental Properties
- PSA: 12.03
Pyrrolidine,2-(5-hexen-1-yl)-5-nonyl- Related Literature
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Bo Wei,Zhenyu Liu,Chen Xie,Shu Yang,Wentao Tang,Aiwei Gu,Wing-Tak Wong,Ka-Leung Wong J. Mater. Chem. C, 2015,3, 12322-12327
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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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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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Albertus D. Handoko,Khoong Hong Khoo,Teck Leong Tan,Hongmei Jin,Zhi Wei Seh J. Mater. Chem. A, 2018,6, 21885-21890
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David White,Sean R. Stowell Biomater. Sci., 2017,5, 463-474
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