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Home > Pyridines > 113975-42-1
113975-42-1 | 1H-Pyrrolo[2,3-c]pyridine, 2-(1,1-dimethylethyl)-
CAS No: 113975-42-1 Catalog No: AG000A7X MDL No:MFCD07776600
Product Description
Catalog Number:
AG000A7X
Chemical Name:
1H-Pyrrolo[2,3-c]pyridine, 2-(1,1-dimethylethyl)-
CAS Number:
113975-42-1
Molecular Formula:
C11H14N2
Molecular Weight:
174.2423
MDL Number:
MFCD07776600
IUPAC Name:
2-tert-butyl-1H-pyrrolo[2,3-c]pyridine
InChI:
InChI=1S/C11H14N2/c1-11(2,3)10-6-8-4-5-12-7-9(8)13-10/h4-7,13H,1-3H3
InChI Key:
VJHOIYGZUNWFBF-UHFFFAOYSA-N
SMILES:
CC(c1cc2c([nH]1)cncc2)(C)C
Properties
Complexity:
183
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
174.116g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
174.247g/mol
Monoisotopic Mass:
174.116g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
28.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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