Home Halogens Methyl 4-bromo-1,2,5-thiadiazole-3-carboxylate

Methyl 4-bromo-1,2,5-thiadiazole-3-carboxylate

CAS No.:
152300-56-6
Catalog Number:
AG006UBE
Molecular Formula:
C4H3BrN2O2S
Molecular Weight:
223.0478
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
95%
In Stock USA
United States
$181
- +
1g
95%
In Stock USA
United States
$450
- +
5g
95%
In Stock USA
United States
$1800
- +
Product Description
Catalog Number:
AG006UBE
Chemical Name:
Methyl 4-bromo-1,2,5-thiadiazole-3-carboxylate
CAS Number:
152300-56-6
Molecular Formula:
C4H3BrN2O2S
Molecular Weight:
223.0478
MDL Number:
MFCD10478334
IUPAC Name:
methyl 4-bromo-1,2,5-thiadiazole-3-carboxylate
InChI:
InChI=1S/C4H3BrN2O2S/c1-9-4(8)2-3(5)7-10-6-2/h1H3
InChI Key:
HJPUHNZGOZGRMJ-UHFFFAOYSA-N
SMILES:
COC(=O)c1nsnc1Br
Properties
Complexity:
145  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
221.91g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
223.044g/mol
Monoisotopic Mass:
221.91g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
80.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  
Properties