5-Methoxy-6-nitroindoline - CAS 23772-38-5

Catalog:	BB018176
Product Name:	5-Methoxy-6-nitroindoline
CAS:	23772-38-5
Synonyms:	5-methoxy-6-nitro-2,3-dihydro-1H-indole; 5-methoxy-6-nitro-2,3-dihydro-1H-indole

Technical Data

Patents

Computed Properties

IUPAC Name:	5-methoxy-6-nitro-2,3-dihydro-1H-indole
Description:	5-Methoxy-6-nitroindoline (CAS# 23772-38-5) is a useful research chemical.
Molecular Weight:	194.19
Molecular Formula:	C9H10N2O3
Canonical SMILES:	COC1=C(C=C2C(=C1)CCN2)[N+](=O)[O-]
InChI:	InChI=1S/C9H10N2O3/c1-14-9-4-6-2-3-10-7(6)5-8(9)11(12)13/h4-5,10H,2-3H2,1H3
InChI Key:	XTJWZASEAYSGRT-UHFFFAOYSA-N

Publication Number	Title	Priority Date
WO-2010045451-A1	Pyrrolopyrimidine compounds	20081016
EP-2188292-A1	2- [ (2-{phenylamino}-1h-pyrrolo [2, 3-d]pyrimidin-4-yl) amino]benzamide derivatives as igf-1r inhibitors for the treatment of cancer	20070808
EP-2188292-B1	2- [ (2-{phenylamino}-1h-pyrrolo [2, 3-d]pyrimidin-4-yl) amino]benzamide derivatives as igf-1r inhibitors for the treatment of cancer	20070808
ES-2424977-T3	2 - [(2- {Phenylamino} -1 H -pyrrolo [2,3-D] pyrimidin-4-yl) amino] benzamide derivatives as IGF-1R inhibitors for cancer treatment	20070808
JP-2010535798-A	2-[(2- {Phenylamino} -1H-pyrrolo [2,3-d] pyrimidin-4-yl) amino] benzamide derivatives as IGH-1R inhibitors for the treatment of cancer	20070808

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Complexity:	229
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	194.06914219
Formal Charge:	0
Heavy Atom Count:	14
Hydrogen Bond Acceptor Count:	4
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	194.06914219
Rotatable Bond Count:	1
Topological Polar Surface Area:	67.1
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.7