Cas no 113800-97-8 (N',N'-didodecyl-N,N-dimethylpropane-1,3-diamine)
113800-97-8 structure
Product Name:N',N'-didodecyl-N,N-dimethylpropane-1,3-diamine
CAS No:113800-97-8
MF:C29H62N2
MW:438.815989017487
CID:2611645
PubChem ID:71337720
Update Time:2025-04-21
N',N'-didodecyl-N,N-dimethylpropane-1,3-diamine Chemical and Physical Properties
Names and Identifiers
-
- N',N'-didodecyl-N,N-dimethylpropane-1,3-diamine
- DTXSID60765401
- 113800-97-8
- N~1~,N~1~-Didodecyl-N~3~,N~3~-dimethylpropane-1,3-diamine
-
- Inchi： 1S/C29H62N2/c1-5-7-9-11-13-15-17-19-21-23-27-31(29-25-26-30(3)4)28-24-22-20-18-16-14-12-10-8-6-2/h5-29H2,1-4H3
- InChI Key： UNAGNUXTRVECSN-UHFFFAOYSA-N
- SMILES： N(CCCN(C)C)(CCCCCCCCCCCC)CCCCCCCCCCCC
Computed Properties
- Exact Mass: 438.491299986Da
- Monoisotopic Mass: 438.491299986Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 31
- Rotatable Bond Count: 26
- Complexity: 292
- 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: 11.8
- Topological Polar Surface Area: 6.5?2
N',N'-didodecyl-N,N-dimethylpropane-1,3-diamine Related Literature
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Joseph H. Bisesi,Tara Sabo-Attwood Environ. Sci.: Nano, 2014,1, 574-583
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Nan Fu,Naphaporn Chiewchan,Xiao Dong Chen Food Funct., 2020,11, 211-220
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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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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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David White,Sean R. Stowell Biomater. Sci., 2017,5, 463-474
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