Cas no 28354-22-5 (Acetonitrile,2-[(3-methylphenyl)amino]-)
28354-22-5 structure
Product Name:Acetonitrile,2-[(3-methylphenyl)amino]-
Acetonitrile,2-[(3-methylphenyl)amino]- Chemical and Physical Properties
Names and Identifiers
-
- Acetonitrile,2-[(3-methylphenyl)amino]-
- 2-(3-methylanilino)acetonitrile
- (3-Methyl-phenylamino)-acetonitril
- [(3-methylphenyl)amino]acetonitrile
- < 3-Methyl-phenylamino> -acetonitril
- 2-(3-methylanilino)-acetonitrile
- AC1L1R70
- ACETONITRILE, m-TOLUIDINO-
- Acetonitrile, m-tolylamino-
- BRN 2638752
- CTK4G1291
- m-Tolylaminoacetonitrile
- N-Cyanomethyl-3-methylanilin
- AKOS000253442
- SCHEMBL11269588
- 28354-22-5
- DTXSID60182598
-
- Inchi: 1S/C9H10N2/c1-8-3-2-4-9(7-8)11-6-5-10/h2-4,7,11H,6H2,1H3
- InChI Key: MOQXGUQHBPOHDN-UHFFFAOYSA-N
- SMILES: N(CC#N)C1C=CC=C(C)C=1
Computed Properties
- Exact Mass: 146.0845
- Monoisotopic Mass: 146.084398
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 11
- Rotatable Bond Count: 2
- Complexity: 156
- 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
- Topological Polar Surface Area: 35.8
- XLogP3: 2.1
Experimental Properties
- Density: 1.082
- Boiling Point: 316.9°Cat760mmHg
- Flash Point: 145.5°C
- Refractive Index: 1.584
- PSA: 35.82
Acetonitrile,2-[(3-methylphenyl)amino]- Related Literature
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Supaporn Sawadjoon,Joseph S. M. Samec Org. Biomol. Chem., 2011,9, 2548-2554
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2. An amorphous lanthanum–iridium solid solution with an open structure for efficient water splitting?Wei Sun,Chenglong Ma,Xinlong Tian,Jianjun Liao,Ji Yang,Chengjun Ge,Weiwei Huang J. Mater. Chem. A, 2020,8, 12518-12525
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Suji Lee,Min Su Han Chem. Commun., 2021,57, 9450-9453
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H. V. Jain,D. Verthelyi,S. L. Beaucage RSC Adv., 2017,7, 42519-42528
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Raheleh Torabi,Hedayatollah Ghourchian,Massoud Amanlou Org. Biomol. Chem., 2016,14, 8141-8153
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