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20042-86-8 | 1,2,4-Dithiazolidine-3-thione, 4-methyl-5-(methylimino)-, hydrobromide (1:1)
CAS No: 20042-86-8 Catalog No: AG002CRH MDL No:
Product Description
Catalog Number:
AG002CRH
Chemical Name:
1,2,4-Dithiazolidine-3-thione, 4-methyl-5-(methylimino)-, hydrobromide (1:1)
CAS Number:
20042-86-8
Molecular Formula:
C4H7BrN2S3
Molecular Weight:
259.2108
IUPAC Name:
4-methyl-5-methylimino-1,2,4-dithiazolidin-4-ium-3-thione;bromide
InChI:
InChI=1S/C4H6N2S3.BrH/c1-5-3-6(2)4(7)9-8-3;/h1-2H3;1H
InChI Key:
VNRZQMPPRKZBRB-UHFFFAOYSA-N
SMILES:
Cn1c(=NC)ssc1=S.Br
Properties
Complexity:
165
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
257.895g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
259.198g/mol
Monoisotopic Mass:
257.895g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
99.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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