Cas no 1936-38-5 (2-chloro-N-(2-chloroethyl)-N-[(2-methyl-1,3-thiazol-4-yl)methyl]ethanamine dihydrochloride)
![2-chloro-N-(2-chloroethyl)-N-[(2-methyl-1,3-thiazol-4-yl)methyl]ethanamine dihydrochloride structure](https://ossimg.kuujia.com/scimg/2000/1936-38-5x500.png)
1936-38-5 structure
Product Name:2-chloro-N-(2-chloroethyl)-N-[(2-methyl-1,3-thiazol-4-yl)methyl]ethanamine dihydrochloride
CAS No:1936-38-5
MF:C9H16Cl4N2S
MW:326.113737106323
CID:1386516
PubChem ID:121226
Update Time:2025-04-20
2-chloro-N-(2-chloroethyl)-N-[(2-methyl-1,3-thiazol-4-yl)methyl]ethanamine dihydrochloride Chemical and Physical Properties
Names and Identifiers
-
- 2-chloro-N-(2-chloroethyl)-N-[(2-methyl-1,3-thiazol-4-yl)methyl]ethanamine dihydrochloride
- 4-((Bis(2-chloroethyl)amino)methyl)-2-methylthiazole dihydrochloride
- DTXSID90172967
- 1936-38-5
- Thiazole, 4-((bis(2-chloroethyl)amino)methyl)-2-methyl-, dihydrochloride
- 2-Methyl-4-di-(beta-chloroethyl)aminomethylthiazole dihydrochloride
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- Inchi： 1S/C9H14Cl2N2S.2ClH/c1-8-12-9(7-14-8)6-13(4-2-10)5-3-11;;/h7H,2-6H2,1H3;2*1H
- InChI Key： BZISRIADDCHXTQ-UHFFFAOYSA-N
- SMILES： ClCCN(CCCl)CC1=CSC(C)=N1.Cl.Cl
Computed Properties
- Exact Mass: 323.97918
- Monoisotopic Mass: 323.97883
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 16
- Rotatable Bond Count: 6
- Complexity: 154
- Covalently-Bonded Unit Count: 3
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 44.4
Experimental Properties
- Boiling Point: 269.8°C at 760 mmHg
- Flash Point: 116.9°C
- PSA: 16.13
2-chloro-N-(2-chloroethyl)-N-[(2-methyl-1,3-thiazol-4-yl)methyl]ethanamine dihydrochloride Related Literature
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Inês S. Albuquerque,Hélia F. Jeremias,Miguel Chaves-Ferreira,Dijana Matak-Vinkovic,Omar Boutureira,Carlos C. Rom?o Chem. Commun., 2015,51, 3993-3996
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Dhamodaran Manikandan,S. Amirthapandian,I. S. Zhidkov,A. I. Kukharenko,S. O. Cholakh,Ramaswamy Murugan Phys. Chem. Chem. Phys., 2018,20, 6500-6514
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Chengbin Yang,Hing Lun Tsang,Pui Man Lau,Ken-Tye Yong,Ho Pui Ho,Siu Kai Kong Analyst, 2017,142, 3579-3587
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Bo Cao,Yin Wei Chem. Commun., 2018,54, 2870-2873
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Jingquan Liu,Huiyun Liu,Zhongfan Jia,Volga Bulmus,Thomas P. Davis Chem. Commun., 2008, 6582-6584
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