((o-Methoxyphenoxy)methyl)oxirane
Basic information
- CAS
2210-74-4- Standard SMILES
COc1ccccc1OCC1CO1- InChIKey
RJNVSQLNEALZLC-UHFFFAOYSA-N- Molecular formula
- C10H12O3
- Average molar mass
- 180.2 g/mol
- Monoisotopic mass
- 180.07864424
Names & identifiers
- Preferred name
- ((o-Methoxyphenoxy)methyl)oxirane
- IUPAC
- 2-[(2-methoxyphenoxy)methyl]oxirane
- English name
- Guaiacol glycidyl ether
- Molecular formula
- C10H12O3
- Molecular weight
- 180.2
Names & synonyms
((o-Methoxyphenoxy)methyl)oxirane[(o-methoxyphenoxy)methyl]oxiraneRefChem:390436218-644-82210-74-41-(2-Methoxyphenoxy)-2,3-epoxypropaneGuaiacol glycidyl ether2-[(2-methoxyphenoxy)methyl]oxiraneGlycidyl 2-Methoxyphenyl Ether2-((2-methoxyphenoxy)methyl)oxirane[(2-methoxyphenoxy)methyl]oxirane1,2-Epoxy-3-(2-methoxyphenoxy)propane
Show more names
Ranolazine USP Related Compound A1-(2-Methoxyphenoxy) -2,3-Epoxy PropaneRZ-3RZ-1
NSC 1334421,2-Epoxy-3-(o-methoxyphenoxy)propaneMFCD00190158Oxirane, [(2-methoxyphenoxy)methyl]-Guajacol-glycidaetherNSC 112256Z96AT4ECV61-(2,3-Epoxypropoxy)-2-methoxybenzene
Database identifiers
- CAS
2210-74-4- PubChem CID
- 98357
- DTXSID
DTXSID601292484- UNII
- Z96AT4ECV6
- EC Number
- 218-644-8
- Nikkaji
- J50.918C
Properties
Computed structural properties
- XLogP
- 1.6
- Topological polar surface area
- 31 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 160
Physicochemical properties
- Melting point
- 33 · 33-36°C
- Boiling point
- 152 · 152-158℃
- Density
- 1.142 · 1.142±0.06 g/cm3(Predicted)
- RTECS
- 3550000 · TZ3550000
- storage temp.
- Sealed in dry,Room Temperature
- solubility
- soluble in Chloroform, Methanol
- form
- Solid
- color
- Off-white
- Water Solubility
- 4.21 g/L · 4.21g/L at 20℃
- Major Application
- pharmaceutical
- InChI
- InChI=1S/C10H12O3/c1-11-9-4-2-3-5-10(9)13-7-8-6-12-8/h2-5,8H,6-7H2,1H3
- InChIKey
- RJNVSQLNEALZLC-UHFFFAOYSA-N
- SMILES
- O1CC1COC1=CC=CC=C1OC
- LogP
- 1.54 at · 1.54 at 25℃
- CAS DataBase Reference
- 2210 · 2210-74-4(CAS DataBase Reference)
- FDA UNII
- 96 AT4ECV6 · Z96AT4ECV6
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
This chemical does not meet GHS hazard criteria for 23.1% (3 of 13) of reports.
Warning
H315 (69.2%): Causes skin irritation [Warning Skin corrosion/irritation]
P203, P261, P264, P264+P265, P271, P272, P280, P302+P352, P304+P340, P305+P351+P338, P318, P319, P321, P332+P317, P333+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 13 reports by companies from 6 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Regulatory InformationREACH registered substance: [(o-methoxyphenoxy)methyl]oxirane (EC: 218-644-8)
Hazard Classes and CategoriesSkin Irrit. 2 (69.2%)
Safety data
- wgk
- WGK 3
- hs_code
- 29109000
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Storage Class
- 11 - Combustible Solids
- Hazard statements
- H315-H317
- REACH Registrations
- Active
- Hazard Classifications
- Skin Irrit. 2Skin Sens. 1
- Precautionary statements
- P280-P302+P352
Chemistry & industry
Applications
UsesRanolazine intermediate
Upstream & downstream products
Upstream raw materials
Downstream products
Suppliers
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Related reactions
24 records
Compound notes
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