Cas no 15190-06-4 (Benzeneacetonitrile, a-[(4-methylphenyl)amino]-)
15190-06-4 structure
Product Name:Benzeneacetonitrile, a-[(4-methylphenyl)amino]-
CAS No:15190-06-4
MF:C15H14N2
MW:222.285063266754
CID:193288
PubChem ID:347506
Update Time:2025-04-19
Benzeneacetonitrile, a-[(4-methylphenyl)amino]- Chemical and Physical Properties
Names and Identifiers
-
- Benzeneacetonitrile, a-[(4-methylphenyl)amino]-
- (2R)-2-(4-methylanilino)-2-phenylacetonitrile
- 2-(2-tolyl)thiophene
- 2-(4-methylphenyl)-1,3-thiazolane
- 2-(4-methylphenyl)-thiazolidine
- 2-(4-methylphenyl)thiophene
- 2-(4-methylphenylamino)-2-phenylacetonitrile
- 2-(4-tolyl)thiophene
- 2-(p-Methylphenyl)thiazolidine
- 2-(p-Tolyl)thiazolidine
- 2-[N-(4-methylanilino)]-2-phenylacetonitrile
- 2-phenyl-2-(p-tolylamino)acetonitrile
- 2-p-tolyl-thiazolidine
- 2-p-tolyl-thiophene
- F1912-0010
- methylphenylthiazolane
- Thiazolidine, 2-(p-tolyl)-
- NSC-406222
- 15190-06-4
- NSC406222
- AKOS005793361
-
- Inchi: 1S/C15H14N2/c1-12-7-9-14(10-8-12)17-15(11-16)13-5-3-2-4-6-13/h2-10,15,17H,1H3
- InChI Key: XECYKIVQTHEAFN-UHFFFAOYSA-N
- SMILES: N(C1C=CC(C)=CC=1)C(C#N)C1C=CC=CC=1
Computed Properties
- Exact Mass: 222.11582
- Monoisotopic Mass: 222.116
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 17
- Rotatable Bond Count: 3
- Complexity: 264
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 3.8
- Topological Polar Surface Area: 35.8?2
Experimental Properties
- Density: 1.131
- Boiling Point: 378.8°C at 760 mmHg
- Flash Point: 182.9°C
- Refractive Index: 1.627
- PSA: 35.82
- LogP: 3.74478
Benzeneacetonitrile, a-[(4-methylphenyl)amino]- Related Literature
-
Congyu Li,Wenfu Wang,Haiyan Wang,Guokai Yan,Weiyang Dong,Zhaosheng Chu,Huan Wang,Yang Chang RSC Adv., 2021,11, 26721-26731
-
Alexandre Vimont,Arnaud Travert,Philippe Bazin,Jean-Claude Lavalley,Marco Daturi,Christian Serre,Gérard Férey,Sandrine Bourrelly,Philip L. Llewellyn Chem. Commun., 2007, 3291-3293
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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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