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Home Aminos Methyl [(5-amino-1,3,4-thiadiazol-2-yl)thio]acetate

Methyl [(5-amino-1,3,4-thiadiazol-2-yl)thio]acetate

CAS No.:
72836-12-5
Catalog Number:
AG005OOH
Molecular Formula:
C5H7N3O2S2
Molecular Weight:
205.2580
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$96
- +
5g
95%
In Stock USA
United States
$216
- +
Product Description
Catalog Number:
AG005OOH
Chemical Name:
Methyl [(5-amino-1,3,4-thiadiazol-2-yl)thio]acetate
CAS Number:
72836-12-5
Molecular Formula:
C5H7N3O2S2
Molecular Weight:
205.2580
MDL Number:
MFCD01798985
IUPAC Name:
methyl 2-[(5-amino-1,3,4-thiadiazol-2-yl)sulfanyl]acetate
InChI:
InChI=1S/C5H7N3O2S2/c1-10-3(9)2-11-5-8-7-4(6)12-5/h2H2,1H3,(H2,6,7)
InChI Key:
ASSFIPIQXCHMOD-UHFFFAOYSA-N
SMILES:
COC(=O)CSc1nnc(s1)N
Properties
Complexity:
169  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
204.998g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
205.25g/mol
Monoisotopic Mass:
204.998g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
132A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8  
Properties