Home Halogens 3-(bromomethyl)-1,2,5-thiadiazole

3-(bromomethyl)-1,2,5-thiadiazole

CAS No.:
53012-70-7
Catalog Number:
AG019SHK
Molecular Formula:
C3H3BrN2S
Molecular Weight:
179.0383
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Product Description
Catalog Number:
AG019SHK
Chemical Name:
3-(bromomethyl)-1,2,5-thiadiazole
CAS Number:
53012-70-7
Molecular Formula:
C3H3BrN2S
Molecular Weight:
179.0383
MDL Number:
MFCD20621956
IUPAC Name:
3-(bromomethyl)-1,2,5-thiadiazole
InChI:
InChI=1S/C3H3BrN2S/c4-1-3-2-5-7-6-3/h2H,1H2
InChI Key:
LJZAHEYFCLYGND-UHFFFAOYSA-N
SMILES:
BrCc1cnsn1
Properties
Complexity:
60.9  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
177.92g/mol
Formal Charge:
0
Heavy Atom Count:
7  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
179.035g/mol
Monoisotopic Mass:
177.92g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
54A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1  
Properties