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54681-68-4

54681-68-4 | 5-Bromo-3-methyl-1,2,4-thiadiazole

CAS No: 54681-68-4 Catalog No: AG0038NP MDL No:MFCD11847500

Product Description

Catalog Number:
AG0038NP
Chemical Name:
5-Bromo-3-methyl-1,2,4-thiadiazole
CAS Number:
54681-68-4
Molecular Formula:
C3H3BrN2S
Molecular Weight:
179.0383
MDL Number:
MFCD11847500
IUPAC Name:
5-bromo-3-methyl-1,2,4-thiadiazole
InChI:
InChI=1S/C3H3BrN2S/c1-2-5-3(4)7-6-2/h1H3
InChI Key:
LRFYFSQFLKUMEP-UHFFFAOYSA-N
SMILES:
Cc1nsc(n1)Br

Properties

Complexity:
70  
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:
0
Topological Polar Surface Area:
54A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  

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