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25674-36-6 | Thieno[3,4-b]thiophene-4-carboxaldehyde
CAS No: 25674-36-6 Catalog No: AG007MCV MDL No:MFCD18451755
Product Description
Catalog Number:
AG007MCV
Chemical Name:
Thieno[3,4-b]thiophene-4-carboxaldehyde
CAS Number:
25674-36-6
Molecular Formula:
C7H4OS2
Molecular Weight:
168.2361
MDL Number:
MFCD18451755
IUPAC Name:
thieno[2,3-c]thiophene-4-carbaldehyde
InChI:
InChI=1S/C7H4OS2/c8-3-6-5-1-2-9-7(5)4-10-6/h1-4H
InChI Key:
JCHVKBQUVSXNQW-UHFFFAOYSA-N
SMILES:
O=Cc1scc2c1ccs2
Properties
Complexity:
149
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
167.97g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
168.228g/mol
Monoisotopic Mass:
167.97g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
73.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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