3-Iodo-7-azaindole - CAS 23616-57-1

Catalog:	BB018118
Product Name:	3-Iodo-7-azaindole
CAS:	23616-57-1
Synonyms:	3-iodo-1H-pyrrolo[2,3-b]pyridine

Technical Data

Safety and Hazards

Patents

Computed Properties

IUPAC Name:	3-iodo-1H-pyrrolo[2,3-b]pyridine
Description:	3-Iodo-7-azaindole (CAS# 23616-57-1) is a useful research chemical and a synthesis intermediate.
Molecular Weight:	244.03
Molecular Formula:	C7H5IN2
Canonical SMILES:	C1=CC2=C(NC=C2I)N=C1
InChI:	InChI=1S/C7H5IN2/c8-6-4-10-7-5(6)2-1-3-9-7/h1-4H,(H,9,10)
InChI Key:	BTIANIFSBYIGPA-UHFFFAOYSA-N
Boiling Point:	360.7 °C at 760 mmHg
Melting Point:	190-194 °C
Purity:	95 %
Density:	2.082 g/cm³
Appearance:	White to brown solid
MDL:	MFCD06659023
LogP:	2.16750

Publication Number	Title	Priority Date
WO-2021032148-A1	Aminopyrazine compounds as hpk1 inhibitor and the use thereof	20190821
US-2020317665-A1	Protein tyrosine phosphatase inhibitors	20190402
TW-202102490-A	Protein tyrosine phosphatase inhibitors	20190402
US-2020131474-A1	Methods and compositions for ocular cell therapy	20181026
WO-2019228442-A1	Jak3 selective inhibitor	20180530

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Related Functional Groups

Azaindoles

[945840-68-6]
7-Chloro-4-methyl-6-azaindole
[885500-55-0]
Ethyl 4-chloro-1H-pyrrolo[2,3-b]pyridine-5-carboxylate
[1190318-85-4]
3-Iodo-7-methoxy-4-azaindole
[55052-28-3]
4-Chloro-7-azaindole
[1824051-84-4]
3-iodo-1-methyl-1H-pyrrolo[3,2-c]pyridine
[1000341-55-8]
6-Chloro-3-iodo-1H-pyrrolo[3,2-c]pyridine

Indoles

[2170450-99-2]
4-Methyl-1-(phenylsulfonyl)-1H-indole-2-carbonitrile
[53995-78-1]
Ethyl 5,6-dichloro-1H-indole-2-carboxylate
[1375064-43-9]
Ethyl 3-Bromo-7-methylindole-1-carboxylate
[37033-95-7]
Ethyl 5-(benzyloxy)-1H-indole-2-carboxylate
[32996-16-0]
Ethyl indole-5-carboxylate
[50820-65-0]
Methyl indole-6-carboxylate

GHS Hazard Statement:	H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement:	P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P310, P312, P321, P330, P332+P313, P362, P403+P233, P405, and P501
Signal Word:	Danger

Complexity:	129
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	243.94975
Formal Charge:	0
Heavy Atom Count:	10
Hydrogen Bond Acceptor Count:	1
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	243.94975
Rotatable Bond Count:	0
Topological Polar Surface Area:	28.7 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2