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Home > Aldehydes > 1190312-08-3
1190312-08-3 | 1H-Pyrrolo[2,3-b]pyridine-4-carboxaldehyde, 3-amino-
CAS No: 1190312-08-3 Catalog No: AG000HJ3 MDL No:
Product Description
Catalog Number:
AG000HJ3
Chemical Name:
1H-Pyrrolo[2,3-b]pyridine-4-carboxaldehyde, 3-amino-
CAS Number:
1190312-08-3
Molecular Formula:
C8H7N3O
Molecular Weight:
161.1607
IUPAC Name:
3-amino-1H-pyrrolo[2,3-b]pyridine-4-carbaldehyde
InChI:
InChI=1S/C8H7N3O/c9-6-3-11-8-7(6)5(4-12)1-2-10-8/h1-4H,9H2,(H,10,11)
InChI Key:
LENNKEQVJGKAJN-UHFFFAOYSA-N
SMILES:
O=Cc1ccnc2c1c(N)c[nH]2
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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