Cas no 1282-85-5 (Isodecanamine (9CI))
Isodecanamine (9CI) structure
Product Name:Isodecanamine (9CI)
Isodecanamine (9CI) Chemical and Physical Properties
Names and Identifiers
-
- Isodecanamine (9CI)
- 8-methylnonan-1-amine
- isodecylamine
- Isodecanamine
- Einecs 215-064-7
- SCHEMBL1003892
- DTXSID10155838
- NS00021584
- 1282-85-5
-
- Inchi: 1S/C10H23N/c1-10(2)8-6-4-3-5-7-9-11/h10H,3-9,11H2,1-2H3
- InChI Key: LJQFHDUFUVMPSP-UHFFFAOYSA-N
- SMILES: NCCCCCCCC(C)C
Computed Properties
- Exact Mass: 157.18319
- Monoisotopic Mass: 157.183049738g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 11
- Rotatable Bond Count: 7
- Complexity: 69.3
- 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: 3.9
- Topological Polar Surface Area: 26?2
Experimental Properties
- PSA: 26.02
Isodecanamine (9CI) Related Literature
-
Yaqing Liu,Jiangtao Ren,Jing Li,Jiyang Liu,Erkang Wang Chem. Commun., 2012,48, 802-804
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Robert J. Meagher,Anson V. Hatch,Ronald F. Renzi,Anup K. Singh Lab Chip, 2008,8, 2046-2053
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