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144506-62-7 | Carbamodithioic acid, methylenebis- (9CI)
CAS No: 144506-62-7 Catalog No: AG001JNX MDL No:
Product Description
Catalog Number:
AG001JNX
Chemical Name:
Carbamodithioic acid, methylenebis- (9CI)
CAS Number:
144506-62-7
Molecular Formula:
C3H6N2S4
Molecular Weight:
198.3531
IUPAC Name:
(dithiocarboxyamino)methylcarbamodithioic acid
InChI:
InChI=1S/C3H6N2S4/c6-2(7)4-1-5-3(8)9/h1H2,(H2,4,6,7)(H2,5,8,9)
InChI Key:
KZSJAGBYWSYWAK-UHFFFAOYSA-N
SMILES:
SC(=S)NCNC(=S)S
Properties
Complexity:
109
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
197.941g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
198.335g/mol
Monoisotopic Mass:
197.941g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
90.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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