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1190309-98-8 | 1H-Pyrrolo[2,3-c]pyridine-7-carboxylic acid, 3-formyl-
CAS No: 1190309-98-8 Catalog No: AG000P40 MDL No:MFCD12963313
Product Description
Catalog Number:
AG000P40
Chemical Name:
1H-Pyrrolo[2,3-c]pyridine-7-carboxylic acid, 3-formyl-
CAS Number:
1190309-98-8
Molecular Formula:
C9H6N2O3
Molecular Weight:
190.1555
MDL Number:
MFCD12963313
IUPAC Name:
3-formyl-1H-pyrrolo[2,3-c]pyridine-7-carboxylic acid
InChI:
InChI=1S/C9H6N2O3/c12-4-5-3-11-7-6(5)1-2-10-8(7)9(13)14/h1-4,11H,(H,13,14)
InChI Key:
VJNOOKLWHLYNMQ-UHFFFAOYSA-N
SMILES:
O=Cc1c[nH]c2c1ccnc2C(=O)O
Properties
Complexity:
256
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
190.038g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
190.158g/mol
Monoisotopic Mass:
190.038g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
83A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3
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