5-Bromo-2-isopropylpyridine - CAS 1159820-58-2

Catalog:	BB055289
Product Name:	5-Bromo-2-isopropylpyridine
CAS:	1159820-58-2
Synonyms:	5-BROMO-2-ISOPROPYLPYRIDINE; 5-bromo-2-propan-2-ylpyridine; 3-BROMO-6-(ISO-PROPYL)PYRIDINE; Pyridine, 5-bromo-2-(1-methylethyl)-; 5-Bromo-2-isopropyl-pyridine

Technical Data

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Computed Properties

IUPAC Name:	5-bromo-2-propan-2-ylpyridine
Molecular Weight:	200.08
Molecular Formula:	C8H10BrN
Canonical SMILES:	CC(C)C1=NC=C(C=C1)Br
InChI:	InChI=1S/C8H10BrN/c1-6(2)8-4-3-7(9)5-10-8/h3-6H,1-2H3
InChI Key:	RJXNVJKFIQGNGY-UHFFFAOYSA-N

Publication Number	Title	Priority Date
WO-2021011713-A1	Imidazopyrimidines as eed inhibitors and the use thereof	20190716
TW-202116772-A	Imidazopyrimidines as eed inhibitors and the use thereof	20190716
CN-114127073-A	Imidazopyrimidines as EED inhibitors and uses thereof	20190716
WO-2020102576-A1	Compounds and compositions for treating conditions associated with nlrp activity	20181116
EP-3611165-A1	Pyridone compound, and agricultural and horticultural fungicide having this as active component	20170411
US-2020048218-A1	Apoptosis signal-regulating kinase 1 (ask 1) inhibitor compounds	20170327
US-2016264560-A1	Small molecule c-myc inhibitors	20131211
WO-2015089180-A1	Small molecule c-myc inhibitors	20131211
WO-2014135474-A1	Inhibitors of bruton's tyrosine kinase	20130305
US-2015239866-A1	Triazolyl derivatives as syk inhibitors	20120928

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GHS Hazard Statement:	H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
Precautionary Statement:	P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, 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:	12.9Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2.7