Cas no 89882-40-6 (1,13-Tridecanediol, 7-(1H-imidazol-1-ylmethyl)-)
89882-40-6 structure
Product Name:1,13-Tridecanediol, 7-(1H-imidazol-1-ylmethyl)-
CAS No:89882-40-6
MF:C17H32N2O2
MW:296.448184967041
CID:585891
PubChem ID:71326752
Update Time:2025-04-19
1,13-Tridecanediol, 7-(1H-imidazol-1-ylmethyl)- Chemical and Physical Properties
Names and Identifiers
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- 1,13-Tridecanediol, 7-(1H-imidazol-1-ylmethyl)-
- 7-(imidazol-1-ylmethyl)tridecane-1,13-diol
- 89882-40-6
- DTXSID50755891
- 7-[(1H-Imidazol-1-yl)methyl]tridecane-1,13-diol
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- Inchi： 1S/C17H32N2O2/c20-13-7-3-1-5-9-17(10-6-2-4-8-14-21)15-19-12-11-18-16-19/h11-12,16-17,20-21H,1-10,13-15H2
- InChI Key： UHSJFQHQUJJPCX-UHFFFAOYSA-N
- SMILES： OCCCCCCC(CN1C=NC=C1)CCCCCCO
Computed Properties
- Exact Mass: 296.246378268g/mol
- Monoisotopic Mass: 296.246378268g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 21
- Rotatable Bond Count: 14
- Complexity: 213
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 3.1
- Topological Polar Surface Area: 58.3?2
1,13-Tridecanediol, 7-(1H-imidazol-1-ylmethyl)- Related Literature
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Ziyang Deng,Changwei Chen,Sunliang Cui RSC Adv., 2016,6, 93753-93755
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Bin Han,Yasuo Shimizu,Gabriele Seguini,Celia Castro,Gérard Ben Assayag,Koji Inoue,Yasuyoshi Nagai,Sylvie Schamm-Chardon,Michele Perego RSC Adv., 2016,6, 3617-3622
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Olga Guselnikova,Gérard Audran,Jean-Patrick Joly,Andrii Trelin,Evgeny V. Tretyakov,Vaclav Svorcik,Oleksiy Lyutakov,Sylvain R. A. Marque Chem. Sci., 2021,12, 4154-4161
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