Cas no 109306-94-7 (Benzamide,4-amino-N-(2,6-dimethylphenyl)-3,5-dimethyl-)
109306-94-7 structure
Product Name:Benzamide,4-amino-N-(2,6-dimethylphenyl)-3,5-dimethyl-
CAS No:109306-94-7
MF:C17H20N2O
MW:268.353504180908
CID:155950
PubChem ID:131012
Update Time:2025-04-19
Benzamide,4-amino-N-(2,6-dimethylphenyl)-3,5-dimethyl- Chemical and Physical Properties
Names and Identifiers
-
- Benzamide,4-amino-N-(2,6-dimethylphenyl)-3,5-dimethyl-
- 4-Amino-N-(2,6-dimethylphenyl)-3,5-dimethylbenzamide
- LY201409
- AKOS040748798
- DTXSID80148873
- 109306-94-7
- SCHEMBL10401521
- LY-201409
- CHEMBL45879
- LY 201409
- Benzamide, 4-amino-N-(2,6-dimethylphenyl)-3,5-dimethyl-
-
- Inchi： 1S/C17H20N2O/c1-10-6-5-7-11(2)16(10)19-17(20)14-8-12(3)15(18)13(4)9-14/h5-9H,18H2,1-4H3,(H,19,20)
- InChI Key： ZSXGPMMRFFQFCH-UHFFFAOYSA-N
- SMILES： O=C(C1C=C(C)C(=C(C)C=1)N)NC1C(C)=CC=CC=1C
Computed Properties
- Exact Mass: 268.1577
- Monoisotopic Mass: 268.158
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 20
- Rotatable Bond Count: 2
- Complexity: 322
- 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: 3.5
- Topological Polar Surface Area: 55.1?2
Experimental Properties
- Density: 1.138
- Boiling Point: 387.7°Cat760mmHg
- Flash Point: 188.3°C
- Refractive Index: 1.634
- PSA: 55.12
- LogP: 4.40890
Benzamide,4-amino-N-(2,6-dimethylphenyl)-3,5-dimethyl- Related Literature
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Bidou Wang,Xifeng Chen Analyst, 2014,139, 5695-5699
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Bo Cao,Yin Wei Chem. Commun., 2018,54, 2870-2873
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Doug Ogrin,Laura H. van Poppel,Simon G. Bott,Andrew R. Barron Dalton Trans., 2004, 3689-3694
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Yaqing Liu,Jiangtao Ren,Jing Li,Jiyang Liu,Erkang Wang Chem. Commun., 2012,48, 802-804
-
Huabin Zhang,Shaowu Du CrystEngComm, 2014,16, 4059-4068
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