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23145-19-9 | 2-Benzofurancarboxaldehyde, 5-methoxy-
CAS No: 23145-19-9 Catalog No: AG002MCS MDL No:MFCD01413839
Product Description
Catalog Number:
AG002MCS
Chemical Name:
2-Benzofurancarboxaldehyde, 5-methoxy-
CAS Number:
23145-19-9
Molecular Formula:
C10H8O3
Molecular Weight:
176.1687
MDL Number:
MFCD01413839
IUPAC Name:
5-methoxy-1-benzofuran-2-carbaldehyde
InChI:
InChI=1S/C10H8O3/c1-12-8-2-3-10-7(4-8)5-9(6-11)13-10/h2-6H,1H3
InChI Key:
OPAYERWEZXLSFC-UHFFFAOYSA-N
SMILES:
COc1ccc2c(c1)cc(o2)C=O
Properties
Complexity:
193
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
176.047g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
176.171g/mol
Monoisotopic Mass:
176.047g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
39.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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