Home Sulfos 1-cyclopentyl-5-methanesulfonyl-1H-1,2,3,4-tetrazole

1-cyclopentyl-5-methanesulfonyl-1H-1,2,3,4-tetrazole

CAS No.:
1152878-96-0
Catalog Number:
AG01A9JG
Molecular Formula:
C7H12N4O2S
Molecular Weight:
216.2608
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Product Description
Catalog Number:
AG01A9JG
Chemical Name:
1-cyclopentyl-5-methanesulfonyl-1H-1,2,3,4-tetrazole
CAS Number:
1152878-96-0
Molecular Formula:
C7H12N4O2S
Molecular Weight:
216.2608
MDL Number:
MFCD11105970
IUPAC Name:
1-cyclopentyl-5-methylsulfonyltetrazole
InChI:
InChI=1S/C7H12N4O2S/c1-14(12,13)7-8-9-10-11(7)6-4-2-3-5-6/h6H,2-5H2,1H3
InChI Key:
ZGNQLXAODYTLRV-UHFFFAOYSA-N
SMILES:
CS(=O)(=O)c1nnnn1C1CCCC1
Properties
Complexity:
293  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
216.068g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
216.259g/mol
Monoisotopic Mass:
216.068g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
86.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3  
Properties