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1864051-71-7 | 4-METHYL-2-(PYRROLIDIN-3-YLSULFANYL)-1,3-THIAZOLE HYDROCHLORIDE
CAS No: 1864051-71-7 Catalog No: AG01AT8L MDL No:MFCD26793091
Product Description
Catalog Number:
AG01AT8L
Chemical Name:
4-METHYL-2-(PYRROLIDIN-3-YLSULFANYL)-1,3-THIAZOLE HYDROCHLORIDE
CAS Number:
1864051-71-7
Molecular Formula:
C8H13ClN2S2
Molecular Weight:
236.7852
MDL Number:
MFCD26793091
IUPAC Name:
4-methyl-2-pyrrolidin-3-ylsulfanyl-1,3-thiazole;hydrochloride
InChI:
InChI=1S/C8H12N2S2.ClH/c1-6-5-11-8(10-6)12-7-2-3-9-4-7;/h5,7,9H,2-4H2,1H3;1H
InChI Key:
RQOUOGZKRNHBSJ-UHFFFAOYSA-N
SMILES:
Cc1csc(n1)SC1CNCC1.Cl
Properties
Complexity:
154
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:
2
Topological Polar Surface Area:
78.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
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