2-Bromo-6-isopropylpyridine - CAS 1037223-35-0

Catalog:	BB001213
Product Name:	2-Bromo-6-isopropylpyridine
CAS:	1037223-35-0
Synonyms:	2-bromo-6-propan-2-ylpyridine; 2-bromo-6-propan-2-ylpyridine

Technical Data

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Computed Properties

IUPAC Name:	2-bromo-6-propan-2-ylpyridine
Description:	2-Bromo-6-isopropylpyridine (CAS# 1037223-35-0) is a useful research chemical.
Molecular Weight:	200.08
Molecular Formula:	C8H10BrN
Canonical SMILES:	CC(C)C1=NC(=CC=C1)Br
InChI:	InChI=1S/C8H10BrN/c1-6(2)7-4-3-5-8(9)10-7/h3-6H,1-2H3
InChI Key:	GNBUFPXDJYBELS-UHFFFAOYSA-N
Storage:	Inert atmosphere, 2-8 °C
LogP:	2.96750

Publication Number	Title	Priority Date
US-2021115065-A1	Compounds and compositions for the treatment of parasitic diseases	20191021
WO-2021078120-A1	Compounds and compositions for the treatment of parasitic diseases	20191021
WO-2020083404-A1	Pyrimidopyrazolone derivative as wee1 inhibitor and use thereof	20181026
US-2020048218-A1	Apoptosis signal-regulating kinase 1 (ask 1) inhibitor compounds	20170327
CN-110198943-A	1,2- dihydro -3H- pyrazoles [3,4-d] pyrimidine -3- ketone derivatives as Wee1 inhibitor	20170123

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GHS Hazard Statement:	H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]; H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]; H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]; H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
Precautionary Statement:	P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501
Signal Word:	Warning

Complexity:	103
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	198.99966
Formal Charge:	0
Heavy Atom Count:	10
Hydrogen Bond Acceptor Count:	1
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	198.99966
Rotatable Bond Count:	1
Topological Polar Surface Area:	12.9
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	3