Cas no 18039-03-7 (Benzamide,N,2,4-trimethyl-)
Benzamide,N,2,4-trimethyl- structure
Product Name:Benzamide,N,2,4-trimethyl-
CAS No:18039-03-7
MF:C10H13NO
MW:163.216322660446
CID:122731
PubChem ID:925387
Update Time:2025-04-18
Benzamide,N,2,4-trimethyl- Chemical and Physical Properties
Names and Identifiers
-
- Benzamide,N,2,4-trimethyl-
- Benzamide, N,2,4-trimethyl- (8CI,9CI)
- N,2,4-Trimethylbenzamide
- SCHEMBL328219
- Z32016701
- DTXSID80358935
- 18039-03-7
- AKOS003810583
-
- Inchi： 1S/C10H13NO/c1-7-4-5-9(8(2)6-7)10(12)11-3/h4-6H,1-3H3,(H,11,12)
- InChI Key： HZLHGEXSJCRLKS-UHFFFAOYSA-N
- SMILES： O=C(C1C=CC(C)=CC=1C)NC
Computed Properties
- Exact Mass: 163.09979
- Monoisotopic Mass: 163.099714038g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 12
- Rotatable Bond Count: 1
- Complexity: 167
- 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: 1.7
- Topological Polar Surface Area: 29.1?2
Experimental Properties
- PSA: 29.1
Benzamide,N,2,4-trimethyl- Related Literature
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1. Fatty acid eutectic mixtures and derivatives from non-edible animal fat as phase change materials?Pau Gallart-Sirvent,Marc Martín,Gemma Villorbina,Mercè Balcells,Aran Solé,Luisa F. Cabeza,Ramon Canela-Garayoa RSC Adv., 2017,7, 24133-24139
-
Ivor Lon?ari? Phys. Chem. Chem. Phys., 2015,17, 9436-9445
-
Norihito Fukui,Keisuke Fujimoto,Hideki Yorimitsu,Atsuhiro Osuka Dalton Trans., 2017,46, 13322-13341
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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
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A. B. F. da Silva,K. Capelle Phys. Chem. Chem. Phys., 2009,11, 4564-4569
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