Cas no 4697-92-1 ( )
structure
Product Name:
CAS No:4697-92-1
MF:C11H26N2
MW:186.337543010712
CID:930630
PubChem ID:227550
Update Time:2025-04-19
Chemical and Physical Properties
Names and Identifiers
-
- 1,3-Bis-butylamino-propan
- 1,3-Diamino-N,N'-dibutyl-propan
- A,10
- A,17
- AR-1A7016
- KST-1A4932
- N,N'-dibutyl-1,3-propanediamine
- N,N'-Dibutyl-propandiyldiamin
- N,N'-dibutyl-propane-1,3-diamine
- N,N'-dibutyl-propanediyldiamine
- N,N'-Dibutyl-trimethylendiamin
- 4697-92-1
- SCHEMBL2168247
- NSC19165
- NSC-19165
- N1,N3-Dibutylpropane-1,3-diamine
- GMTISLOMZKMDTF-UHFFFAOYSA-N
-
-
- Inchi： 1S/C11H26N2/c1-3-5-8-12-10-7-11-13-9-6-4-2/h12-13H,3-11H2,1-2H3
- InChI Key： GMTISLOMZKMDTF-UHFFFAOYSA-N
- SMILES： N(CCCC)CCCNCCCC
Computed Properties
- Exact Mass: 186.20978
- Monoisotopic Mass: 186.21
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 13
- Rotatable Bond Count: 10
- Complexity: 74.2
- 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: 2.8
- Topological Polar Surface Area: 24.1?2
Experimental Properties
- Density: 0.818
- Boiling Point: 259.4°C at 760 mmHg
- Flash Point: 128.8°C
- Refractive Index: 1.441
- PSA: 24.06
- LogP: 2.93770
Related Literature
-
Xixi Li,Nanwei Zhu,Ruohan Li,Qinpu Zhang Anal. Methods, 2020,12, 3376-3381
-
Xin Fu,Qing-rong Liang,Rong-guang Luo,Yan-shu Li,Xiao-ping Xiao,Lu-lu Yu,Wen-zhe Shan,Guang-qin Fan J. Mater. Chem. B, 2019,7, 3088-3099
-
Bo Cao,Yin Wei Chem. Commun., 2018,54, 2870-2873
-
L. Di Michele,D. Fiocco,F. Varrato,E. Eiser,G. Foffi Soft Matter, 2014,10, 3633-3648
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