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182750-86-3 | 3H-Thiazolo[3,4-c]pyrimidine (9CI)
CAS No: 182750-86-3 Catalog No: AG00243Q MDL No:
Product Description
Catalog Number:
AG00243Q
Chemical Name:
3H-Thiazolo[3,4-c]pyrimidine (9CI)
CAS Number:
182750-86-3
Molecular Formula:
C6H6N2S
Molecular Weight:
138.1902
IUPAC Name:
3H-[1,3]thiazolo[3,4-c]pyrimidine
InChI:
InChI=1S/C6H6N2S/c1-2-7-4-8-5-9-3-6(1)8/h1-4H,5H2
InChI Key:
VWPOONFTCALNMV-UHFFFAOYSA-N
SMILES:
c1ncn2c(=CSC2)c1
Properties
Complexity:
205
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
138.025g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
138.188g/mol
Monoisotopic Mass:
138.025g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
40.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5
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