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Home > Aldehydes > 119116-94-8
119116-94-8 | 2-Benzofuranacetaldehyde
CAS No: 119116-94-8 Catalog No: AG000I81 MDL No:
Product Description
Catalog Number:
AG000I81
Chemical Name:
2-Benzofuranacetaldehyde
CAS Number:
119116-94-8
Molecular Formula:
C10H8O2
Molecular Weight:
160.1693
IUPAC Name:
2-(2-benzofuran-1-yl)acetaldehyde
InChI:
InChI=1S/C10H8O2/c11-6-5-10-9-4-2-1-3-8(9)7-12-10/h1-4,6-7H,5H2
InChI Key:
NOVMHMZDYZIKAZ-UHFFFAOYSA-N
SMILES:
O=CCc1occ2c1cccc2
Properties
Complexity:
167
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
160.052g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
160.172g/mol
Monoisotopic Mass:
160.052g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
30.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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