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Home > Pyridines > 145901-16-2
145901-16-2 | 1H-Pyrrolo[2,3-b]pyridine, 6-ethynyl-
CAS No: 145901-16-2 Catalog No: AG001DHW MDL No:MFCD11616380
Product Description
Catalog Number:
AG001DHW
Chemical Name:
1H-Pyrrolo[2,3-b]pyridine, 6-ethynyl-
CAS Number:
145901-16-2
Molecular Formula:
C9H6N2
Molecular Weight:
142.1573
MDL Number:
MFCD11616380
IUPAC Name:
6-ethynyl-1H-pyrrolo[2,3-b]pyridine
InChI:
InChI=1S/C9H6N2/c1-2-8-4-3-7-5-6-10-9(7)11-8/h1,3-6H,(H,10,11)
InChI Key:
ZUCRVWKDOKGUPW-UHFFFAOYSA-N
SMILES:
C#Cc1ccc2c(n1)[nH]cc2
Properties
Complexity:
191
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
142.053g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
142.161g/mol
Monoisotopic Mass:
142.053g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
28.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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