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Home > Pyridines > 1279202-47-9
1279202-47-9 | 3-PYRROLO[2,3-B]PYRIDIN-1-YL-PROPIONIC ACID
CAS No: 1279202-47-9 Catalog No: AG01DV6F MDL No:MFCD18785161
Product Description
Catalog Number:
AG01DV6F
Chemical Name:
3-PYRROLO[2,3-B]PYRIDIN-1-YL-PROPIONIC ACID
CAS Number:
1279202-47-9
Molecular Formula:
C10H10N2O2
Molecular Weight:
190.1986
MDL Number:
MFCD18785161
IUPAC Name:
3-pyrrolo[2,3-b]pyridin-1-ylpropanoic acid
InChI:
InChI=1S/C10H10N2O2/c13-9(14)4-7-12-6-3-8-2-1-5-11-10(8)12/h1-3,5-6H,4,7H2,(H,13,14)
InChI Key:
KNBIEZUXUHXIQJ-UHFFFAOYSA-N
SMILES:
OC(=O)CCn1ccc2c1nccc2
Properties
Complexity:
220
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
190.074g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
190.202g/mol
Monoisotopic Mass:
190.074g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
55.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
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