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443729-67-7 | 1-(4-Iodo-1H-pyrrolo[2,3-b]pyridin-1-yl)ethanone
CAS No: 443729-67-7 Catalog No: AG0071Y8 MDL No:MFCD09880006
Product Description
Catalog Number:
AG0071Y8
Chemical Name:
1-(4-Iodo-1H-pyrrolo[2,3-b]pyridin-1-yl)ethanone
CAS Number:
443729-67-7
Molecular Formula:
C9H7IN2O
Molecular Weight:
286.0691
MDL Number:
MFCD09880006
IUPAC Name:
1-(4-iodopyrrolo[2,3-b]pyridin-1-yl)ethanone
InChI:
InChI=1S/C9H7IN2O/c1-6(13)12-5-3-7-8(10)2-4-11-9(7)12/h2-5H,1H3
InChI Key:
SDDUGTXURCFAKQ-UHFFFAOYSA-N
SMILES:
Ic1ccnc2c1ccn2C(=O)C
Properties
Complexity:
222
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
285.96g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
286.072g/mol
Monoisotopic Mass:
285.96g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
34.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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