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Home > Aldehydes > 290333-01-6
290333-01-6 | 1H-Pyrrolo[2,3-b]pyridine-2-carboxaldehyde, 4-methoxy-
CAS No: 290333-01-6 Catalog No: AG002V9O MDL No:MFCD08448197
Product Description
Catalog Number:
AG002V9O
Chemical Name:
1H-Pyrrolo[2,3-b]pyridine-2-carboxaldehyde, 4-methoxy-
CAS Number:
290333-01-6
Molecular Formula:
C9H8N2O2
Molecular Weight:
176.1720
MDL Number:
MFCD08448197
IUPAC Name:
4-methoxy-1H-pyrrolo[2,3-b]pyridine-2-carbaldehyde
InChI:
InChI=1S/C9H8N2O2/c1-13-8-2-3-10-9-7(8)4-6(5-12)11-9/h2-5H,1H3,(H,10,11)
InChI Key:
OYSFOBMHBVCVNI-UHFFFAOYSA-N
SMILES:
COc1ccnc2c1cc([nH]2)C=O
Properties
Complexity:
198
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
176.059g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
176.175g/mol
Monoisotopic Mass:
176.059g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
55A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
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