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Home > Thiazole > 1864053-25-7
1864053-25-7 | 2-((AZETIDIN-3-YLMETHYL)THIO)-4-METHYLTHIAZOLE HYDROCHLORIDE
CAS No: 1864053-25-7 Catalog No: AG01ASI6 MDL No:MFCD28125866
Product Description
Catalog Number:
AG01ASI6
Chemical Name:
2-((AZETIDIN-3-YLMETHYL)THIO)-4-METHYLTHIAZOLE HYDROCHLORIDE
CAS Number:
1864053-25-7
Molecular Formula:
C8H13ClN2S2
Molecular Weight:
236.7852
MDL Number:
MFCD28125866
IUPAC Name:
2-(azetidin-3-ylmethylsulfanyl)-4-methyl-1,3-thiazole;hydrochloride
InChI:
InChI=1S/C8H12N2S2.ClH/c1-6-4-11-8(10-6)12-5-7-2-9-3-7;/h4,7,9H,2-3,5H2,1H3;1H
InChI Key:
ZFWMZPRYLDTKOZ-UHFFFAOYSA-N
SMILES:
Cc1csc(n1)SCC1CNC1.Cl
Properties
Complexity:
150
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
236.021g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
236.776g/mol
Monoisotopic Mass:
236.021g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
78.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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