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Home > Aldehydes > 249504-37-8
249504-37-8 | 2-Thiophenecarboxaldehyde, 5-(3-methoxyphenyl)-
CAS No: 249504-37-8 Catalog No: AG002PYH MDL No:MFCD06410190
Product Description
Catalog Number:
AG002PYH
Chemical Name:
2-Thiophenecarboxaldehyde, 5-(3-methoxyphenyl)-
CAS Number:
249504-37-8
Molecular Formula:
C12H10O2S
Molecular Weight:
218.2716
MDL Number:
MFCD06410190
IUPAC Name:
5-(3-methoxyphenyl)thiophene-2-carbaldehyde
InChI:
InChI=1S/C12H10O2S/c1-14-10-4-2-3-9(7-10)12-6-5-11(8-13)15-12/h2-8H,1H3
InChI Key:
DLXLICDIIBNILO-UHFFFAOYSA-N
SMILES:
COc1cccc(c1)c1ccc(s1)C=O
Properties
Complexity:
220
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
218.04g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
218.27g/mol
Monoisotopic Mass:
218.04g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
54.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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