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73909-00-9 | THIOCYANIC ACID IODOMETHYL ESTER
CAS No: 73909-00-9 Catalog No: AG005AKY MDL No:
Product Description
Catalog Number:
AG005AKY
Chemical Name:
THIOCYANIC ACID IODOMETHYL ESTER
CAS Number:
73909-00-9
Molecular Formula:
C2H2INS
Molecular Weight:
199.0135
IUPAC Name:
iodomethyl thiocyanate
InChI:
InChI=1S/C2H2INS/c3-1-5-2-4/h1H2
InChI Key:
MEZLHPGTFGWNAW-UHFFFAOYSA-N
SMILES:
ICSC#N
Properties
Complexity:
53.9
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
198.895g/mol
Formal Charge:
0
Heavy Atom Count:
5
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
199.009g/mol
Monoisotopic Mass:
198.895g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
49.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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