Home Other Building Blocks 1-cyclopropyl-1H-1,2,3,4-tetrazole-5-thiol

1-cyclopropyl-1H-1,2,3,4-tetrazole-5-thiol

CAS No.:
637781-10-3
Catalog Number:
AG019M8M
Molecular Formula:
C4H6N4S
Molecular Weight:
142.1822
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Product Description
Catalog Number:
AG019M8M
Chemical Name:
1-cyclopropyl-1H-1,2,3,4-tetrazole-5-thiol
CAS Number:
637781-10-3
Molecular Formula:
C4H6N4S
Molecular Weight:
142.1822
MDL Number:
MFCD08271790
IUPAC Name:
1-cyclopropyl-2H-tetrazole-5-thione
InChI:
InChI=1S/C4H6N4S/c9-4-5-6-7-8(4)3-1-2-3/h3H,1-2H2,(H,5,7,9)
InChI Key:
GBAMURSLHHWGCH-UHFFFAOYSA-N
SMILES:
Sc1nnnn1C1CC1
Properties
Complexity:
173  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
142.031g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
142.18g/mol
Monoisotopic Mass:
142.031g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
72.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8  
Properties