Ethyl 2-(pyridin-3-yloxy)acetate

HCID 4763754

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Basic information

CAS: 18342-98-8
Standard SMILES: CCOC(=O)COc1cccnc1
InChIKey: XNRUOZBZALSKNK-UHFFFAOYSA-N
Molecular formula: C9H11NO3
Average molar mass: 181.19 g/mol
Monoisotopic mass: 181.07389321

Names & identifiers

Preferred name: Ethyl 2-(pyridin-3-yloxy)acetate
IUPAC: ethyl 2-pyridin-3-yloxyacetate
English name: ethyl 2-(pyridin-3-yloxy)acetate
Molecular formula: C9H11NO3
Molecular weight: 181.19

Names & synonyms

18342-98-8ethyl 2-(pyridin-3-yloxy)acetateEthyl 2-pyridin-3-yloxyacetate(Pyridin-3-yloxy)acetic acid ethyl ester(Pyridin-3-yloxy)-acetic acid ethyl esterMFCD00093962ethyl 2-(3-pyridyloxy)acetateethyl 3-pyridyloxyacetateAcetic acid, 2-(3-pyridinyloxy)-, ethyl esterSCHEMBL6067800ethyl2-(pyridin-3-yloxy)acetateDTXSID40406340

Show more names

ethyl (pyridin-3-yloxy)acetateEthyl 3-pyridyloxyacetate, 98%3-EthoxycarbonylMethoxypyridine

XNRUOZBZALSKNK-UHFFFAOYSA-NEthyl [(pyridin-3-yl)oxy]acetateethyl 2-(pyridin-3-yloxy)-acetateAKOS000285750DS-0925DB-0654462-(3-Pyridinyloxy)acetic acid, ethyl esterCS-0217952

Database identifiers

CAS: 18342-98-8
PubChem CID: 4763754
DTXSID: DTXSID40406340
EC Number: 691-938-5

Properties

Computed structural properties

XLogP: 1.1
Topological polar surface area: 48.4 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 4
Rotatable bonds: 5
Heavy atoms: 13
Formal charge: 0
Complexity: 161

Physicochemical properties

Boiling point: 270.6 · 270.6±15.0 °C(Predicted)
Density: 1.157 · 1.157
refractive index: 1.506 · 1.506
storage temp.: Inert atmosphere,Room Temperature
pka: 4.36 · 4.36±0.10(Predicted)
CAS DataBase Reference: 18342 · 18342-98-8
Symbol(GHS): 7 · GHS07
Signal word: Warning
Hazard statements: 315 · H315-H319-H335
Precautionary statements: 261 · P261-P280a-P304+P340-P305+P351+P338-P405-P501a
HS Code: 2933399990 · 2933399990

Safety & regulation

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 4 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.