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Home > Aldehydes > 219537-99-2
219537-99-2 | 4,4'-(cyclopent-1-ene-1,2-diyl)bis(5-methylthiophene-2-carbaldehyde)
CAS No: 219537-99-2 Catalog No: AG01DJUG MDL No:
Product Description
Catalog Number:
AG01DJUG
Chemical Name:
4,4'-(cyclopent-1-ene-1,2-diyl)bis(5-methylthiophene-2-carbaldehyde)
CAS Number:
219537-99-2
Molecular Formula:
C17H16O2S2
Molecular Weight:
316.4377
IUPAC Name:
4-[2-(5-formyl-2-methylthiophen-3-yl)cyclopenten-1-yl]-5-methylthiophene-2-carbaldehyde
InChI:
InChI=1S/C17H16O2S2/c1-10-16(6-12(8-18)20-10)14-4-3-5-15(14)17-7-13(9-19)21-11(17)2/h6-9H,3-5H2,1-2H3
InChI Key:
KNJCDIPBYVYSCY-UHFFFAOYSA-N
SMILES:
O=Cc1sc(c(c1)C1=C(CCC1)c1cc(sc1C)C=O)C
Properties
Complexity:
420
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
316.059g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
316.433g/mol
Monoisotopic Mass:
316.059g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
90.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4
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