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1630-99-5 | Methanamine, N-1,3-dithiolan-2-ylidene-
CAS No: 1630-99-5 Catalog No: AG001TLR MDL No:
Product Description
Catalog Number:
AG001TLR
Chemical Name:
Methanamine, N-1,3-dithiolan-2-ylidene-
CAS Number:
1630-99-5
Molecular Formula:
C4H7NS2
Molecular Weight:
133.2351
IUPAC Name:
N-methyl-1,3-dithiolan-2-imine
InChI:
InChI=1S/C4H7NS2/c1-5-4-6-2-3-7-4/h2-3H2,1H3
InChI Key:
HNMNUKSODUKBLM-UHFFFAOYSA-N
SMILES:
CN=C1SCCS1
Properties
Complexity:
81.7
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
133.002g/mol
Formal Charge:
0
Heavy Atom Count:
7
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
133.227g/mol
Monoisotopic Mass:
133.002g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
63A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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