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Home > Aldehydes > 1007388-21-7
1007388-21-7 | 3-Thiophenecarboxaldehyde, 4-[2-(4-chlorophenyl)ethenyl]-
CAS No: 1007388-21-7 Catalog No: AG0002QO MDL No:
Product Description
Catalog Number:
AG0002QO
Chemical Name:
3-Thiophenecarboxaldehyde, 4-[2-(4-chlorophenyl)ethenyl]-
CAS Number:
1007388-21-7
Molecular Formula:
C13H9ClOS
Molecular Weight:
248.7280
IUPAC Name:
4-[2-(4-chlorophenyl)ethenyl]thiophene-3-carbaldehyde
InChI:
InChI=1S/C13H9ClOS/c14-13-5-2-10(3-6-13)1-4-11-8-16-9-12(11)7-15/h1-9H
InChI Key:
ZXSVWILBEKFPJA-UHFFFAOYSA-N
SMILES:
O=Cc1cscc1C=Cc1ccc(cc1)Cl
Properties
Complexity:
259
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
248.006g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
248.724g/mol
Monoisotopic Mass:
248.006g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
45.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
4
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