Cas no 119301-02-9 (Octanediimidamide)
Octanediimidamide structure
Product Name:Octanediimidamide
CAS No:119301-02-9
MF:C8H18N4
MW:170.255321025848
CID:132161
PubChem ID:4386521
Update Time:2025-04-19
Octanediimidamide Chemical and Physical Properties
Names and Identifiers
-
- Octanediimidamide
- 1,6-DIAMIDINOHEXANE
- Octandiamidin
- octanediamidine
- Suberamidine(6CI)
- Suberinsaeureamidin
- AKOS006295192
- CHEMBL105668
- 1,7-diimino-1,7-octanediamine
- 119301-02-9
- DTXSID60402723
- BDBM50032477
- SCHEMBL23668354
- D33122
-
- Inchi： 1S/C8H18N4/c9-7(10)5-3-1-2-4-6-8(11)12/h1-6H2,(H3,9,10)(H3,11,12)
- InChI Key： BVHMSBKWWMXRLG-UHFFFAOYSA-N
- SMILES： NC(CCCCCCC(=N)N)=N
Computed Properties
- Exact Mass: 170.15300
- Monoisotopic Mass: 170.153146591g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 4
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 12
- Rotatable Bond Count: 7
- Complexity: 135
- 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: -0.1
- Topological Polar Surface Area: 99.7?2
Experimental Properties
- PSA: 99.74000
- LogP: 2.79900
Octanediimidamide Related Literature
-
Andreas Nenning,Manuel Holzmann,Jürgen Fleig,Alexander K. Opitz Mater. Adv., 2021,2, 5422-5431
-
Yong Ping Huang,Tao Tao,Zheng Chen,Wei Han,Ying Wu,Chunjiang Kuang,Shaoxiong Zhou,Ying Chen J. Mater. Chem. A, 2014,2, 18831-18837
-
Tengfei Yu,Yuehan Wu,Wei Li,Bin Li RSC Adv., 2014,4, 34134-34143
-
Xinhuan Wang,Shuangfei Cai,Cui Qi Analyst, 2017,142, 2500-2506
119301-02-9 (Octanediimidamide) Related Products
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