Cas no 871-25-0 (AET dichloride)
AET dichloride structure
Product Name:AET dichloride
CAS No:871-25-0
MF:C3H11Cl2N3S
MW:192.110536813736
CID:721420
Update Time:2023-08-02
AET dichloride Chemical and Physical Properties
Names and Identifiers
-
- Carbamimidothioic acid,2-aminoethyl ester, hydrochloride (1:2)
- 2-(Aminoethyl)-isothiouronium dihydrochloride
- AET dichloride
- 2-Aminoethylisothiouronium dichloride
- 2-Aminoethyl-2-thiopseudourea dichloride
- S-beta-Aminoethylisothiouronic dihydrochloride
- Pseudourea, 2-thio-, 2-aminoethyl-, dichloride
- 2-(2-Aminoethyl)-2-thiopseudourea dihydrochloride
- Pseudourea, 2-aminoethyl-2-thio-, dihydrochloride
- beta-Aminoaethylisothiuronium-chlorid-hydrochlorid [German]
- beta-Aminoaethylisothiuronium-chlorid-hydrochlorid
- 2-Aminoethyl carbamimidothioate--hydrogen chloride (1/
-
- Inchi： 1S/C3H9N3S.2ClH/c4-1-2-7-3(5)6;;/h1-2,4H2,(H3,5,6);2*1H
- InChI Key： KKGIJYWJSRZTHR-UHFFFAOYSA-N
- SMILES： Cl.Cl.S(C(=N)N)CCN
Computed Properties
- Exact Mass: 191.005
- Monoisotopic Mass: 191.005
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 5
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 9
- Rotatable Bond Count: 3
- Complexity: 63.2
- 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: 101
Experimental Properties
- Boiling Point: 231.1°C at 760 mmHg
- Flash Point: 93.6°C
AET dichloride Related Literature
-
S. Amaresh,K. Karthikeyan,K. J. Kim,Y. S. Lee RSC Adv., 2014,4, 23107-23115
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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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M. Sheykhan,S. Khani,S. Shaabanzadeh,M. Joafshan Green Chem., 2017,19, 5940-5948
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