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145286-40-4 | "4,6-dihydro-1H-thieno[3,4-c]pyrazole"
CAS No: 145286-40-4 Catalog No: AG01FMSB MDL No:MFCD01846427
Product Description
Catalog Number:
AG01FMSB
Chemical Name:
"4,6-dihydro-1H-thieno[3,4-c]pyrazole"
CAS Number:
145286-40-4
Molecular Formula:
C5H6N2S
Molecular Weight:
126.1795
MDL Number:
MFCD01846427
IUPAC Name:
4,6-dihydro-1H-thieno[3,4-c]pyrazole
InChI:
InChI=1S/C5H6N2S/c1-4-2-8-3-5(4)7-6-1/h1H,2-3H2,(H,6,7)
InChI Key:
WFUOVUVQGMHJCW-UHFFFAOYSA-N
SMILES:
S1Cc2c(C1)cn[nH]2
Properties
Complexity:
96.4
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
126.025g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
126.177g/mol
Monoisotopic Mass:
126.025g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
54A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3
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