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1241950-73-1 | 1H-Pyrrolo[2,3-b]pyridine-5-carboxylic acid, 2-ethyl-
CAS No: 1241950-73-1 Catalog No: AG000LNB MDL No:MFCD17171307
Product Description
Catalog Number:
AG000LNB
Chemical Name:
1H-Pyrrolo[2,3-b]pyridine-5-carboxylic acid, 2-ethyl-
CAS Number:
1241950-73-1
Molecular Formula:
C10H10N2O2
Molecular Weight:
190.1986
MDL Number:
MFCD17171307
IUPAC Name:
2-ethyl-1H-pyrrolo[2,3-b]pyridine-5-carboxylic acid
InChI:
InChI=1S/C10H10N2O2/c1-2-8-4-6-3-7(10(13)14)5-11-9(6)12-8/h3-5H,2H2,1H3,(H,11,12)(H,13,14)
InChI Key:
YZHXLFCIHKFJDA-UHFFFAOYSA-N
SMILES:
CCc1cc2c([nH]1)ncc(c2)C(=O)O
Properties
Complexity:
232
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:
2
Isotope Atom Count:
0
Molecular Weight:
190.202g/mol
Monoisotopic Mass:
190.074g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
66A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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