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Home > Aldehydes > 126177-51-3
126177-51-3 | 3-Benzofurancarboxaldehyde, 2-amino-
CAS No: 126177-51-3 Catalog No: AG000S00 MDL No:
Product Description
Catalog Number:
AG000S00
Chemical Name:
3-Benzofurancarboxaldehyde, 2-amino-
CAS Number:
126177-51-3
Molecular Formula:
C9H7NO2
Molecular Weight:
161.1574
IUPAC Name:
2-amino-1-benzofuran-3-carbaldehyde
InChI:
InChI=1S/C9H7NO2/c10-9-7(5-11)6-3-1-2-4-8(6)12-9/h1-5H,10H2
InChI Key:
DLDGNSJPAIGFNP-UHFFFAOYSA-N
SMILES:
O=Cc1c(N)oc2c1cccc2
Properties
Complexity:
183
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
161.048g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
161.16g/mol
Monoisotopic Mass:
161.048g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
56.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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