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869959-14-8

869959-14-8 | 2-Thiophenecarboxaldehyde,5-(4-formylphenyl)-

CAS No: 869959-14-8 Catalog No: AG004KBC MDL No:

Product Description

Catalog Number:
AG004KBC
Chemical Name:
2-Thiophenecarboxaldehyde,5-(4-formylphenyl)-
CAS Number:
869959-14-8
Molecular Formula:
C12H8O2S
Molecular Weight:
216.2557
IUPAC Name:
5-(4-formylphenyl)thiophene-2-carbaldehyde
InChI:
InChI=1S/C12H8O2S/c13-7-9-1-3-10(4-2-9)12-6-5-11(8-14)15-12/h1-8H
InChI Key:
GXFWSZUPOMKXHH-UHFFFAOYSA-N
SMILES:
O=Cc1ccc(cc1)c1ccc(s1)C=O

Properties

Complexity:
234  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
216.025g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
216.254g/mol
Monoisotopic Mass:
216.025g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
62.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5  

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