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138764-00-8 | 1,2,3-Thiadiazole, 4-(dimethoxymethyl)-
CAS No: 138764-00-8 Catalog No: AG0019II MDL No:
Product Description
Catalog Number:
AG0019II
Chemical Name:
1,2,3-Thiadiazole, 4-(dimethoxymethyl)-
CAS Number:
138764-00-8
Molecular Formula:
C5H8N2O2S
Molecular Weight:
160.1942
IUPAC Name:
4-(dimethoxymethyl)thiadiazole
InChI:
InChI=1S/C5H8N2O2S/c1-8-5(9-2)4-3-10-7-6-4/h3,5H,1-2H3
InChI Key:
ILRGPGLSZUILPQ-UHFFFAOYSA-N
SMILES:
COC(c1nnsc1)OC
Properties
Complexity:
99.6
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
160.031g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
160.191g/mol
Monoisotopic Mass:
160.031g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
72.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.1
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