2-(4-Ethoxyphenyl)-2-methylpropanol

HCID 158525CAS 83493-63-4
Substructure searchFind similar structures

Basic information

Standard SMILES
CCOc1ccc(C(C)(C)CO)cc1
InChIKey
OZEZBKUHAGFQME-UHFFFAOYSA-N
Molecular formula
C12H18O2
Average molar mass
194.27 g/mol
Monoisotopic mass
194.13067982

Overview

2-(4-ethoxyphenyl)-2-methylpropan-1-ol is a member of propan-1-ols and an aromatic ether. It is functionally related to a 4-tert-butylphenol.

Names & identifiers

Preferred name
2-(4-Ethoxyphenyl)-2-methylpropanol
IUPAC
2-(4-ethoxyphenyl)-2-methylpropan-1-ol
English name
2-(4-Ethoxyphenyl)-2-methylpropanol
Molecular formula
C12H18O2
Molecular weight
194.27

Names & synonyms

2-(4-Ethoxyphenyl)-2-methylpropanol4-ethoxy-beta,beta-dimethylbenzeneethanolRefChem:457508680-130-883493-63-42-(4-ethoxyphenyl)-2-methylpropan-1-olMFCD077872792-(4-ethoxyphenyl)-2-methyl-1-propanolBenzeneethanol, 4-ethoxy-beta,beta-dimethyl-PENAp-ethoxyneophyl alcohol4-ethoxyneophyl alcohol
Show more names
2-(4-ethyoxy phenyl)-2-methyl propanolBenzeneethanol, 4-ethoxy-β,β-dimethyl-2-(4-Ethoxyphenyl)-2-methylpropanol>2-(4-Ethoxyphenyl)-2-methyl-1-propanol2-(4-ETHOXY-PHENYL)-2-METHYL-PROPAN-1-OL
2-(4-ethoxyphenyl)-2-methyl-propan-1-olSCHEMBL7749333CHEBI:39350DTXSID60232401AKOS0063464952,2-dimethyl-2-(4-ethoxyphenyl)ethanolAC-15259AS-63625

Database identifiers

CAS
83493-63-4
PubChem CID
158525
DTXSID
DTXSID60232401
ChEBI
CHEBI:39350
EC Number
680-130-8
Nikkaji
J2.650.628J

Properties

Computed structural properties

XLogP
2.7
Topological polar surface area
29.5 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
2
Rotatable bonds
4
Heavy atoms
14

Experimental & physicochemical properties

PesticidesEnvironmental transformation -> Pesticide transformation products (metabolite, successor)

Physicochemical properties

Melting point
48 °C · 48 °C
Boiling point
294.6 · 294.6±23.0 °C(Predicted)
Density
1 · 1.000±0.06 g/cm3(Predicted)
pka
15.01 · 15.01±0.10(Predicted)
form
powder to crystal
color
White to Light yellow

Safety & regulation

GHS classification

GHS Classification · 4 items

Warning

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

P264, P264+P265, P280, P302+P352, P305+P351+P338, P321, P332+P317, P337+P317, and P362+P364 (click each P-code to see the statement)

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Hazard information

Hazard Classes and CategoriesSkin Irrit. 2 (100%)

Safety data

hs_code
2909498090
Signal word
Warning
Symbol(GHS)
GHS07
Hazard statements
H315-H319
Precautionary statements
P264-P280-P302+P352+P332+P313+P362+P364-P305+P351+P338+P337+P313

Chemistry & industry

Uses & manufacturing

Use ClassificationEnvironmental transformation -> Pesticide transformation products (metabolite, successor)

Applications

UsesAn intermediate of the pyrethroid ethoxyphen.

Upstream & downstream products

Suppliers50 total

梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
陕西缔都新材料有限公司81124267 17392282731 · [email protected]
上海麦克林生化科技股份有限公司021-50706066 15221275939 · [email protected]
湖北成丰化工有限公司13125175253 · [email protected]
杭州摩库生物医药科技有限公司+86-057181025280; +8617767106207 · [email protected]

Additional notes

DefinitionChEBI: 2-(4-ethoxyphenyl)-2-methylpropan-1-ol is a member of propan-1-ols and an aromatic ether. It is functionally related to a 4-tert-butylphenol.

Related reactions

15 records
New reaction record

Linked notes

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