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2,2'-Ethylenedipyridine

HCID 222708
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Basic information

CAS
4916-40-9
Standard SMILES
c1ccc(CCc2ccccn2)nc1
InChIKey
WBIBUCGCVLAPQG-UHFFFAOYSA-N
Molecular formula
C12H12N2
Average molar mass
184.24 g/mol
Monoisotopic mass
184.10004839

Names & identifiers

Preferred name
2,2'-Ethylenedipyridine
IUPAC
2-(2-pyridin-2-ylethyl)pyridine

Names & synonyms

2,2'-ETHYLENEDIPYRIDINERefChem:440301653-299-01,2-Di(pyridin-2-yl)ethane4916-40-92-[2-(PYRIDIN-2-YL)ETHYL]PYRIDINE2-[2-(2-Pyridinyl)ethyl]pyridineNSC94922-(2-(2-pyridyl)ethyl)pyridinePyridine, 2,2'-(1,2-ethanediyl)bis-1,2-di(2-pyridyl)ethaneTimTec1_003367
Show more names
SCHEMBL230753SCHEMBL8670245SCHEMBL29485678DTXSID90278716WBIBUCGCVLAPQG-UHFFFAOYSA-NHMS1543J01NSC-9492Pyridine,2'-(1,2-ethanediyl)bis-

Database identifiers

CAS
4916-40-9
PubChem CID
222708
DTXSID
DTXSID90278716
EC Number
653-299-0
Nikkaji
J553.846G

Properties

Computed structural properties

XLogP
2.1
Topological polar surface area
25.8 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
3
Heavy atoms
14
Formal charge
0
Complexity
140

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

GHS classification

GHS Classification · 4 items

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]

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 (click each P-code to see the statement)

Aggregated GHS information provided per 39 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Hazard information

Hazard Classes and CategoriesSkin Irrit. 2 (100%)

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Compound notes

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