Cas no 160535-46-6 (1,2,3-Propanetricarboxamide, N,N',N''-tris(2-methylcyclohexyl)-)
160535-46-6 structure
Product Name:1,2,3-Propanetricarboxamide, N,N',N''-tris(2-methylcyclohexyl)-
CAS No:160535-46-6
MF:C27H47N3O3
MW:461.680387735367
CID:1339877
PubChem ID:66687139
Update Time:2025-04-20
1,2,3-Propanetricarboxamide, N,N',N''-tris(2-methylcyclohexyl)- Chemical and Physical Properties
Names and Identifiers
-
- 1,2,3-Propanetricarboxamide, N,N',N''-tris(2-methylcyclohexyl)-
- Q27272816
- RIKACLEAR PC 1
- UNII-9O7HDO4IAI
- 9O7HDO4IAI
- SCHEMBL441137
- DTXSID60889035
- NS00076919
- N,N',N''-Tris(2-methylcyclohexyl)-1,2,3-propanetricarboxamide
- 1-N,2-N,3-N-tris(2-methylcyclohexyl)propane-1,2,3-tricarboxamide
- 160535-46-6
- 1,2,3-Propanetricarboxamide, N1,N2,N3-tris(2-methylcyclohexyl)-
- 1,2,3-propanetricarboxylic acid tris(2-methylcyclohexylamide)
- Tricarballylic acid tris(2-methylcyclohexylamide)
-
- Inchi: 1S/C27H47N3O3/c1-18-10-4-7-13-22(18)28-25(31)16-21(27(33)30-24-15-9-6-12-20(24)3)17-26(32)29-23-14-8-5-11-19(23)2/h18-24H,4-17H2,1-3H3,(H,28,31)(H,29,32)(H,30,33)
- InChI Key: NWDVCUXGELFJOC-UHFFFAOYSA-N
- SMILES: O=C(C(CC(NC1CCCCC1C)=O)CC(NC1CCCCC1C)=O)NC1CCCCC1C
Computed Properties
- Exact Mass: 461.36201
- Monoisotopic Mass: 461.36174237g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 3
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 33
- Rotatable Bond Count: 8
- Complexity: 629
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 6
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 4.7
- Topological Polar Surface Area: 87.3?2
Experimental Properties
- PSA: 87.3
1,2,3-Propanetricarboxamide, N,N',N''-tris(2-methylcyclohexyl)- Related Literature
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M. Zeiger,N. J?ckel,P. Strubel,L. Borchardt,R. Reinhold,W. Nickel,J. Eckert,V. Presser,S. Kaskel J. Mater. Chem. A, 2015,3, 17983-17990
-
Nan Fu,Naphaporn Chiewchan,Xiao Dong Chen Food Funct., 2020,11, 211-220
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3. Excimer emission and magnetoluminescence of radical-based zinc(ii) complexes doped in host crystals?Shojiro Kimura,Tetsuro Kusamoto Chem. Commun., 2020,56, 11195-11198
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Joseph H. Bisesi,Tara Sabo-Attwood Environ. Sci.: Nano, 2014,1, 574-583
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Craig A. Kelly,David R. Rosseinsky Phys. Chem. Chem. Phys., 2001,3, 2086-2090
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