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((m-Tolyloxy)methyl)oxirane

HCID 98180
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Basic informationOverviewNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
2186-25-6
Standard SMILES
Cc1cccc(OCC2CO2)c1
InChIKey
WYAFQPYCJBLWAS-UHFFFAOYSA-N
Molecular formula
C10H12O2
Average molar mass
164.2 g/mol
Monoisotopic mass
164.08372962

Overview

See also: m-Cresyl glycidyl ether (annotation moved to).

Names & identifiers

Preferred name
((m-Tolyloxy)methyl)oxirane
IUPAC
2-[(3-methylphenoxy)methyl]oxirane
English name
1,2-Epoxy-3-(3-methylphenoxypropane)
Molecular formula
C10H12O2
Molecular weight
164.2

Names & synonyms

((m-Tolyloxy)methyl)oxirane[(m-tolyloxy)methyl]oxiraneEINECS 218-575-3NSC 86974RefChem:390418218-575-32186-25-61,2-Epoxy-3-(3-methylphenoxypropane)2-[(3-methylphenoxy)methyl]oxiraneMFCD000469902-((M-tolyloxy)methyl)oxirane3-methylphenyl glycidyl ether
Show more names
m-Tolylglycidyl ether(3-methylphenoxy)methylMETA-CRESYLGLYCIDYLETHERm-Methylphenylglycidyl ether2,3-EPOXY PROPYL-M-TOLYL ETHER
2-[(m-Tolyloxy)methyl]oxirane2-((3-Methylphenoxy)methyl)oxiranem-cresyl glycidyl ether3-Methylphenylglycidyl etherNSC869743-Methylphenyl(oxiranylmethyl) etherTOEPm-cresylglycidyl ether

Database identifiers

CAS
2186-25-6
PubChem CID
98180
DTXSID
DTXSID40862861
EC Number
218-575-3
Nikkaji
J59.927A

Properties

Computed structural properties

XLogP
2.4
Topological polar surface area
21.8 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
3
Heavy atoms
12
Formal charge
0
Complexity
147

Physicochemical properties

Boiling point
139.5 · 139.5-140.5 °C(Press: 15 Torr)
Density
1.0801 g/cm3 · 1.0801 g/cm3
Symbol(GHS)
8 · GHS08,GHS07,GHS09
Signal word
Warning
Hazard statements
317 · H317-H411-H341-H315
Precautionary statements
261 · P261-P272-P280-P302+P352-P333+P313-P321-P363-P501-P201-P202-P281-P308+P313-P405-P501-P264-P280-P302+P352-P321-P332+P313-P362

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 · 6 items

Warning

H315: Causes skin irritation [Warning Skin corrosion/irritation]

P203, P261, P264, P272, P273, P280, P302+P352, P318, P321, P332+P317, P333+P317, P362+P364, P391, P405, and P501 (click each P-code to see the statement)

Danger

H302 (95%): Harmful if swallowed [Warning Acute toxicity, oral]

P203, P261, P264, P264+P265, P270, P272, P273, P280, P301+P317, P302+P352, P305+P354+P338, P317, P318, P321, P330, P332+P317, P333+P317, P362+P364, P391, P405, and P501 (click each P-code to see the statement)

Hazard information

Hazard Classes and Categories · 3 items

Acute Tox. 4 (95%)

Germ cell mutagenicity - category 2

Muta. 2

Safety data

Signal word
Warning
Symbol(GHS)
GHS08,GHS07,GHS09
Hazard statements
H317-H411-H341-H315
Precautionary statements
P261-P272-P280-P302+P352-P333+P313-P321-P363-P501-P201-P202-P281-P308+P313-P405-P501-P264-P280-P302+P352-P321-P332+P313-P362

Chemistry & industry

Upstream & downstream products

Downstream products

toliprolol

Related reactions

7 records
New reaction record
HRID 104220 reaction equation
HRID 104220As reactantTraining data from https://doi.org/10.1039/C8SC04228D (2/10)
HRID 136608 reaction equation
HRID 136608As reactantTraining data from https://doi.org/10.1039/C8SC04228D (9/10)
HRID 665366 reaction equation
HRID 665366As productTraining data from https://doi.org/10.1039/C8SC04228D (3/10)
HRID 728819 reaction equation
HRID 728819As reactantuspto-grants-1991_09
HRID 982209 reaction equation
HRID 982209As productuspto-grants-1991_02
HRID 1606806 reaction equation
HRID 1606806As reactantuspto-grants-1976_04
HRID 1769826 reaction equation
HRID 1769826As reactantuspto-grants-1995_01

Compound notes

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