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Home > Aldehydes > 1007387-46-3
1007387-46-3 | 3-Thiophenecarboxaldehyde, 4-[(4-chlorophenyl)methyl]-
CAS No: 1007387-46-3 Catalog No: AG0002QQ MDL No:
Product Description
Catalog Number:
AG0002QQ
Chemical Name:
3-Thiophenecarboxaldehyde, 4-[(4-chlorophenyl)methyl]-
CAS Number:
1007387-46-3
Molecular Formula:
C12H9ClOS
Molecular Weight:
236.7173
IUPAC Name:
4-[(4-chlorophenyl)methyl]thiophene-3-carbaldehyde
InChI:
InChI=1S/C12H9ClOS/c13-12-3-1-9(2-4-12)5-10-7-15-8-11(10)6-14/h1-4,6-8H,5H2
InChI Key:
HHZQGWSGBIVHSL-UHFFFAOYSA-N
SMILES:
O=Cc1cscc1Cc1ccc(cc1)Cl
Properties
Complexity:
214
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
236.006g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
236.713g/mol
Monoisotopic Mass:
236.006g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
45.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
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