Cas no 553-13-9 (zolamine)
zolamine structure
Product Name:zolamine
CAS No:553-13-9
MF:C15H21N3OS
MW:291.41174197197
CID:1593098
PubChem ID:14387
Update Time:2025-04-21
zolamine Chemical and Physical Properties
Names and Identifiers
-
- zolamine
- Zolamine [INN]
- UNII-NXB79TB0N2
- N-(4-methoxybenzyl)-N',N'-dimethyl-N-(1,3-thiazol-2-yl)ethane-1,2-diamine
- N'-[(4-methoxyphenyl)methyl]-N,N-dimethyl-N'-(1,3-thiazol-2-yl)ethane-1,2-diamine
- ZOLAMINE [MI]
- NXB79TB0N2
- NS00123032
- CHEMBL127453
- DTXSID00203817
- 1,2-ETHANEDIAMINE, N-((4-METHOXYPHENYL)METHYL)-N',N'-DIMETHYL-N-2-THIAZOLYL-
- 553-13-9
- KYBJXENQEZJILU-UHFFFAOYSA-N
- 2-((2-(DIMETHYLAMINO)ETHYL)-(P-METHOXYBENZYL)AMINO)THIAZOLE
- Q18385617
- BDBM50225702
- SCHEMBL25864
-
- Inchi： 1S/C15H21N3OS/c1-17(2)9-10-18(15-16-8-11-20-15)12-13-4-6-14(19-3)7-5-13/h4-8,11H,9-10,12H2,1-3H3
- InChI Key： KYBJXENQEZJILU-UHFFFAOYSA-N
- SMILES： S1C=CN=C1N(CC1C=CC(=CC=1)OC)CCN(C)C
Computed Properties
- Exact Mass: 291.140533
- Monoisotopic Mass: 291.140533
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 20
- Rotatable Bond Count: 7
- Complexity: 270
- 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: 56.8
- XLogP3: 2.9
Experimental Properties
- Density: 1.158
- Boiling Point: bp7 217-219°
- Flash Point: 206.1°C
- Refractive Index: 1.597
zolamine Related Literature
-
Ravi Kumar Yadav,R. Govindaraj Phys. Chem. Chem. Phys., 2020,22, 26876-26886
-
Stephen P. Fletcher,Richard B. C. Jagt,Ben L. Feringa Chem. Commun., 2007, 2578-2580
-
Piotr Szcze?niak,Sebastian Stecko RSC Adv., 2015,5, 30882-30888
-
Xixi Li,Nanwei Zhu,Ruohan Li,Qinpu Zhang Anal. Methods, 2020,12, 3376-3381
-
H. V. Jain,D. Verthelyi,S. L. Beaucage RSC Adv., 2017,7, 42519-42528
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