2-Ethyl-6-methylpyridine - CAS 1122-69-6

Name: 2-Ethyl-6-methylpyridine
Brand: BOC Sciences
Rating: 5 (1 reviews)

Catalog:	BB002916
Product Name:	2-Ethyl-6-methylpyridine
CAS:	1122-69-6
Synonyms:	2-ethyl-6-methylpyridine; 2-ethyl-6-methylpyridine

Technical Data

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Computed Properties

IUPAC Name:	2-ethyl-6-methylpyridine
Description:	2-Ethyl-6-methylpyridine (CAS# 1122-69-6) is a useful research chemical.
Molecular Weight:	121.18
Molecular Formula:	C8H11N
Canonical SMILES:	CCC1=CC=CC(=N1)C
InChI:	InChI=1S/C8H11N/c1-3-8-6-4-5-7(2)9-8/h4-6H,3H2,1-2H3
InChI Key:	SFSXNVBMAODLGN-UHFFFAOYSA-N
Boiling Point:	157.9 °C at 760 mmHg
Density:	0.919 g/cm³
Appearance:	Liquid
Storage:	Sealed in dry, 2-8 °C
LogP:	1.95240

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Related Functional Groups

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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

Publication Number	Title	Priority Date
WO-2021011834-A1	Alk5 inhibitors, conjugates, and uses thereof	20190716
WO-2020252262-A1	Reagents and methods for replication, transcription, and translation in semi-synthetic organisms	20190614
US-10829485-B2	ATF6 inhibitors and uses thereof	20180406
WO-2019194207-A1	Heteroaryl-substituted pyrazole compound and medicinal use thereof	20180404
JP-2019156993-A	Process for producing purified tea extract, purified tea extract and perfume composition, and food and drink and cosmetics containing these	20180314

Complexity:	80.6
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	121.089149355
Formal Charge:	0
Heavy Atom Count:	9
Hydrogen Bond Acceptor Count:	1
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	121.089149355
Rotatable Bond Count:	1
Topological Polar Surface Area:	12.9 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2.1