Cas no 73901-52-7 (Thiourea,N-(4-ethoxyphenyl)-N-methyl-)
73901-52-7 structure
Product Name:Thiourea,N-(4-ethoxyphenyl)-N-methyl-
CAS No:73901-52-7
MF:C10H14N2OS
MW:210.295960903168
CID:554896
PubChem ID:45118568
Update Time:2025-04-19
Thiourea,N-(4-ethoxyphenyl)-N-methyl- Chemical and Physical Properties
Names and Identifiers
-
- Thiourea,N-(4-ethoxyphenyl)-N-methyl-
- 1-(4-ethoxyphenyl)-1-methylthiourea
- AG-G-92937
- CTK5D8868
- N-(4-Aethoxy-phenyl)-N-methyl-thioharnstoff
- N-(4-ethoxy-phenyl)-N-methyl-thiourea
- N-(4-Ethoxyphenyl)-N-methylthiourea
- DTXSID50668775
- 73901-52-7
-
- Inchi： 1S/C10H14N2OS/c1-3-13-9-6-4-8(5-7-9)12(2)10(11)14/h4-7H,3H2,1-2H3,(H2,11,14)
- InChI Key： IUBZTOYZICKXST-UHFFFAOYSA-N
- SMILES： S=C(N)N(C)C1C=CC(=CC=1)OCC
Computed Properties
- Exact Mass: 210.083
- Monoisotopic Mass: 210.083
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 14
- Rotatable Bond Count: 3
- Complexity: 191
- 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: 1.2
- Topological Polar Surface Area: 70.6A^2
Thiourea,N-(4-ethoxyphenyl)-N-methyl- Related Literature
-
Erika A. Cobar,Paul R. Horn,Robert G. Bergman,Martin Head-Gordon Phys. Chem. Chem. Phys., 2012,14, 15328-15339
-
Dongjia Han,Bing Xue,Juan Du,Tomohiro Miyatake,Hitoshi Tamiaki,Xin Xing,Wei Yuan,Yanyan Li Phys. Chem. Chem. Phys., 2016,18, 24252-24260
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