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Home > Aldehydes > 1190322-68-9
1190322-68-9 | 1H-Pyrrolo[2,3-b]pyridine-3-carboxaldehyde, 5-amino-
CAS No: 1190322-68-9 Catalog No: AG000I2P MDL No:
Product Description
Catalog Number:
AG000I2P
Chemical Name:
1H-Pyrrolo[2,3-b]pyridine-3-carboxaldehyde, 5-amino-
CAS Number:
1190322-68-9
Molecular Formula:
C8H7N3O
Molecular Weight:
161.1607
IUPAC Name:
5-amino-1H-pyrrolo[2,3-b]pyridine-3-carbaldehyde
InChI:
InChI=1S/C8H7N3O/c9-6-1-7-5(4-12)2-10-8(7)11-3-6/h1-4H,9H2,(H,10,11)
InChI Key:
QJORZLKNVXOENL-UHFFFAOYSA-N
SMILES:
Nc1cc2c(C=O)c[nH]c2nc1
Properties
Complexity:
185
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
161.059g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
161.164g/mol
Monoisotopic Mass:
161.059g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
71.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.1
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