2-Naphthyl glycidyl ether

HCID 92995CAS 5234-06-0

Substructure search Find similar structures

Basic information

Standard SMILES: c1ccc2cc(OCC3CO3)ccc2c1
InChIKey: BKYSFVJCBRHGMA-UHFFFAOYSA-N
Molecular formula: C13H12O2
Average molar mass: 200.23 g/mol
Monoisotopic mass: 200.08372962

Names & identifiers

Preferred name: 2-Naphthyl glycidyl ether
IUPAC: 2-(naphthalen-2-yloxymethyl)oxirane
English name: 2-((2-naphthyloxy)methyl)-oxiran
Molecular formula: C13H12O2
Molecular weight: 200.23

Names & synonyms

5234-06-02-Naphthyl glycidyl ether2-[(naphthalen-2-yloxy)methyl]oxirane2-((naphthalen-2-yloxy)methyl)oxirane2-Glycidyloxynaphthalenebeta-Naphthyl glycidyl etherGlycidyl beta-naphthyl ether(2-naphthyloxymethyl)oxiraneCCRIS 2070((2-Naphthyloxy)methyl)oxiraneEther, 2,3-epoxypropyl 2-naphthylEINECS 226-030-6

Show more names

Propanolol Impurity 5Duloxetine Impurity 362-naphthylglycidylether2-Naphtylglycidyl etherbeta-naphthylglycidyletherglycidylbeta-naphthylether

Oxirane, ((2-naphthalenyloxy)methyl)-[(2-naphthyloxy)methyl]oxiraneAI3-13143TA1R9121W4Oxirane, 2-((2-naphthyloxy)methyl)-Propane, 1,2-epoxy-3-(2-naphthyloxy)-2-[(2-Naphthalenyloxy)methyl]oxiraneGLYCIDYL .BETA.-NAPHTHYL ETHER

Database identifiers

CAS: 5234-06-0
PubChem CID: 92995
DTXSID: DTXSID10966724
ChEMBL: CHEMBL1929348
UNII: TA1R9121W4
EC Number: 226-030-6
Nikkaji: J297.947K

Properties

Computed structural properties

XLogP: 3.2
Topological polar surface area: 21.8 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 2
Rotatable bonds: 3
Heavy atoms: 15
Formal charge: 0
Complexity: 217

Physicochemical properties

Melting point: 60 · 60-64 °C
Boiling point: 200 °C · 200 °C(Press: 16 Torr)
Density: 1.2 g/cm3 · 1.2 g/cm3
FDA UNII: 1 R9121W4 · TA1R9121W4
Symbol(GHS): 8 · GHS08,GHS07,GHS09
Signal word: Warning
Hazard statements: 402 · H402-H315-H319-H361-H351-H341-H317-H411
Precautionary statements: 201 · P201-P202-P281-P308+P313-P405-P501-P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P-P201-P202-P281-P308+P313-P405-P501-P201-P202-P281-P308+P313-P405-P501-P261-P272-P280-P302+P352-P333+P313-P321-P363-P501
REACH Registrations: Active

Safety & regulation

GHS classification

GHS Classification · 4 items

Warning

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

P203, P261, P264, P264+P265, P271, P272, P273, P280, P302+P352, P304+P340, P305+P351+P338, P317, P318, P319, P321, P332+P317, P333+P317, P337+P317, P362+P364, P391, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 6 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Hazard information

Regulatory InformationStatus: Active Update: 14-12-2021 https://echa.europa.eu/registration-dossier/-/registered-dossier/32960

Hazard Classes and CategoriesSkin Irrit. 2 (100%)

Safety data

Signal word: Warning
Symbol(GHS): GHS08,GHS07,GHS09
Hazard statements: H402-H315-H319-H361-H351-H341-H317-H411
REACH Registrations: Active
Precautionary statements: P201-P202-P281-P308+P313-P405-P501-P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P-P201-P202-P281-P308+P313-P405-P501-P201-P202-P281-P308+P313-P405-P501-P261-P272-P280-P302+P352-P333+P313-P321-P363-P501