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89524-41-4 | Methanaminium, N-methyl-N-[(2-propenylthio)methylene]-
CAS No: 89524-41-4 Catalog No: AG003ZSE MDL No:
Product Description
Catalog Number:
AG003ZSE
Chemical Name:
Methanaminium, N-methyl-N-[(2-propenylthio)methylene]-
CAS Number:
89524-41-4
Molecular Formula:
C6H12NS+
Molecular Weight:
130.2312
IUPAC Name:
dimethyl(prop-2-enylsulfanylmethylidene)azanium
InChI:
InChI=1S/C6H12NS/c1-4-5-8-6-7(2)3/h4,6H,1,5H2,2-3H3/q+1
InChI Key:
NXXBKIODMMTOST-UHFFFAOYSA-N
SMILES:
C=CCSC=[N+](C)C
Properties
Complexity:
92.7
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
130.069g/mol
Formal Charge:
1
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
130.229g/mol
Monoisotopic Mass:
130.069g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
28.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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