Home Other Building Blocks 5-(5-CHLORO-2-THIENYL)-1H-TETRAZOLE

5-(5-CHLORO-2-THIENYL)-1H-TETRAZOLE

CAS No.:
58884-89-2
Catalog Number:
AG003M6L
Molecular Formula:
C5H3ClN4S
Molecular Weight:
186.6221
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Product Description
Catalog Number:
AG003M6L
Chemical Name:
5-(5-CHLORO-2-THIENYL)-1H-TETRAZOLE
CAS Number:
58884-89-2
Molecular Formula:
C5H3ClN4S
Molecular Weight:
186.6221
MDL Number:
MFCD01075684
IUPAC Name:
5-(5-chlorothiophen-2-yl)-2H-tetrazole
InChI:
InChI=1S/C5H3ClN4S/c6-4-2-1-3(11-4)5-7-9-10-8-5/h1-2H,(H,7,8,9,10)
InChI Key:
YNPSRXVKAZLDJU-UHFFFAOYSA-N
SMILES:
Clc1ccc(s1)c1nnn[nH]1
Properties
Complexity:
146  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
185.977g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
186.617g/mol
Monoisotopic Mass:
185.977g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
82.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8  
Properties