Cas no 14501-93-0 (Thiourea,N'-(5-chloro-2-methylphenyl)-N,N-dimethyl-)
14501-93-0 structure
Product Name:Thiourea,N'-(5-chloro-2-methylphenyl)-N,N-dimethyl-
CAS No:14501-93-0
MF:C10H13ClN2S
MW:228.741619825363
CID:236707
PubChem ID:3389721
Update Time:2025-04-19
Thiourea,N'-(5-chloro-2-methylphenyl)-N,N-dimethyl- Chemical and Physical Properties
Names and Identifiers
-
- Thiourea,N'-(5-chloro-2-methylphenyl)-N,N-dimethyl-
- 3-(5-chloro-2-methylphenyl)-1,1-dimethylthiourea
- AC1MPQYD
- NSC176353
- NSC-176353
- AKOS002743977
- 14501-93-0
- DTXSID80392051
-
- Inchi： 1S/C10H13ClN2S/c1-7-4-5-8(11)6-9(7)12-10(14)13(2)3/h4-6H,1-3H3,(H,12,14)
- InChI Key： CKTDKLDOXMWLEA-UHFFFAOYSA-N
- SMILES： ClC1C=CC(C)=C(C=1)NC(N(C)C)=S
Computed Properties
- Exact Mass: 228.04899
- Monoisotopic Mass: 228.049
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 14
- Rotatable Bond Count: 1
- Complexity: 208
- 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: 2.5
- Topological Polar Surface Area: 47.4?2
Experimental Properties
- Density: 1.254
- Boiling Point: 294.9°Cat760mmHg
- Flash Point: 132.2°C
- Refractive Index: 1.641
- PSA: 15.27
- LogP: 2.97980
Thiourea,N'-(5-chloro-2-methylphenyl)-N,N-dimethyl- Related Literature
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2. Excimer emission and magnetoluminescence of radical-based zinc(ii) complexes doped in host crystals?Shojiro Kimura,Tetsuro Kusamoto Chem. Commun., 2020,56, 11195-11198
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Byungho Lim,Jaewon Jin,Jin Yoo,Seung Yong Han,Kyeongyeol Kim,Sungah Kang,Nojin Park,Sang Moon Lee,Hae Jin Kim,Seung Uk Son Chem. Commun., 2014,50, 7723-7726
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