5-Bromo-2,3-dihydro-7-azaindole - CAS 115170-40-6

Catalog:	BB003497
Product Name:	5-Bromo-2,3-dihydro-7-azaindole
CAS:	115170-40-6
Synonyms:	5-bromo-2,3-dihydro-1H-pyrrolo[2,3-b]pyridine; 5-bromo-2,3-dihydro-1H-pyrrolo[2,3-b]pyridine

Technical Data

Safety and Hazards

Patents

Computed Properties

IUPAC Name:	5-bromo-2,3-dihydro-1H-pyrrolo[2,3-b]pyridine
Description:	5-Bromo-2,3-dihydro-7-azaindole (CAS# 115170-40-6) is a useful intermediate for organic synthesis.
Molecular Weight:	199.05
Molecular Formula:	C7H7BrN2
Canonical SMILES:	C1CNC2=NC=C(C=C21)Br
InChI:	InChI=1S/C7H7BrN2/c8-6-3-5-1-2-9-7(5)10-4-6/h3-4H,1-2H2,(H,9,10)
InChI Key:	UZGNFPCHQUHZAI-UHFFFAOYSA-N
Boiling Point:	301.277 °C at 760 mmHg
Density:	1.606 g/cm³
Storage:	Keep in dark place, Sealed in dry, Room Temperature
MDL:	MFCD06659750
LogP:	1.95010

Publication Number	Title	Priority Date
KR-20210076876-A	Novel indazole derivatives and use thereof	20191216
WO-2021125802-A1	Novel indazole derivative, and use thereof	20191216
WO-2021093795-A1	Rock inhibitor, preparation method therefor and use thereof	20191115
CN-109081840-B	Preparation method of 5-bromo-7-azaindole	20181109
CN-108473476-A	Alkynyl heterocycle compound for inhibiting protein kinase activity	20161013

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Related Functional Groups

Azaindoles

[1310704-15-4]
Ethyl 4-chloro-1-(triisopropylsilyl)-1H-pyrrolo[2,3-b]pyridine-5-carboxylate
[757978-18-0]
5-Bromo-3-iodo-7-azaindole
[1190315-69-5]
3-Iodo-6-(trifluoromethyl)-5-azaindole
[174610-12-9]
5-Amino-6-azaindole
[850892-97-6]
tert-butyl 4-bromo-1H-pyrrolo[2,3-c]pyridine-1-carboxylate
[10299-69-1]
2,3-Dimethyl-7-azaindole

GHS Hazard Statement:	H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement:	P264, P270, P301+P312, P330, and P501
Signal Word:	Warning

Complexity:	129
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	197.97926
Formal Charge:	0
Heavy Atom Count:	10
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	197.97926
Rotatable Bond Count:	0
Topological Polar Surface Area:	24.9 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.9