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101554-56-7

101554-56-7 | 1H-Tetrazole, 1-methyl-5-(methyldithio)-

CAS No: 101554-56-7 Catalog No: AG0004RR MDL No:

Product Description

Catalog Number:
AG0004RR
Chemical Name:
1H-Tetrazole, 1-methyl-5-(methyldithio)-
CAS Number:
101554-56-7
Molecular Formula:
C3H6N4S2
Molecular Weight:
162.2365
IUPAC Name:
1-methyl-5-(methyldisulfanyl)tetrazole
InChI:
InChI=1S/C3H6N4S2/c1-7-3(9-8-2)4-5-6-7/h1-2H3
InChI Key:
IUZIEKCFCJWFTM-UHFFFAOYSA-N
SMILES:
CSSc1nnnn1C

Properties

Complexity:
89.9  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
162.003g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
162.229g/mol
Monoisotopic Mass:
162.003g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
94.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4  

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