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888498-07-5 | (1H-Pyrrolo[2,3-b]pyridin-4-yl);methanamine
CAS No: 888498-07-5 Catalog No: AG004BKS MDL No:MFCD08458223
Product Description
Catalog Number:
AG004BKS
Chemical Name:
(1H-Pyrrolo[2,3-b]pyridin-4-yl);methanamine
CAS Number:
888498-07-5
Molecular Formula:
C8H9N3
Molecular Weight:
147.1772
MDL Number:
MFCD08458223
IUPAC Name:
1H-pyrrolo[2,3-b]pyridin-4-ylmethanamine
InChI:
InChI=1S/C8H9N3/c9-5-6-1-3-10-8-7(6)2-4-11-8/h1-4H,5,9H2,(H,10,11)
InChI Key:
KPNRVZRVBULYGJ-UHFFFAOYSA-N
SMILES:
NCc1ccnc2c1cc[nH]2
Properties
Complexity:
137
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
147.08g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
147.181g/mol
Monoisotopic Mass:
147.08g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
54.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.2
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