structure of Methyl 2-(4-(2-hydroxyethyl)phenyl)-2-methylpropanoate

Methyl 2-(4-(2-hydroxyethyl)phenyl)-2-methylpropanoate

CAS No.: 1000536-33-3
M. Wt: 222.280
M. Fa: C13H18O3
InChI Key: MHPPJDQIHMPUHJ-UHFFFAOYSA-N

Names and Identifiers of 1000536-33-3

CAS Number

1000536-33-3

IUPAC Name

methyl 2-[4-(2-hydroxyethyl)phenyl]-2-methylpropanoate

InChI

InChI=1S/C13H18O3/c1-13(2,12(15)16-3)11-6-4-10(5-7-11)8-9-14/h4-7,14H,8-9H2,1-3H3

InChIKey

MHPPJDQIHMPUHJ-UHFFFAOYSA-N

Canonical SMILES

CC(C)(C1=CC=C(C=C1)CCO)C(=O)OC

Physical and chemical properties of 1000536-33-3

Acidity coefficient

14.85±0.10(Predicted)

Boiling Point

320.4±22.0 °C at 760 mmHg

Density

1.1±0.1 g/cm3

Exact Mass

222.125595

Flash Point

128.3±15.1 °C

Index of Refraction

1.514

LogP

1.80

Molecular Formula

C13H18O3

Molecular Weight

222.280

PSA

46.53000

Vapour Pressure

0.0±0.7 mmHg at 25°C

Safety Information of 1000536-33-3

Pictograms

Signal Word

 Warning

Safety Data Sheet
Supports customized editing of SDS information and downloading in PDF documents.

Retrosynthesis analysis of 1000536-33-3

  • Route#1

    Cas:149-73-5
    Cas:5337-93-9
    Cas:1000536-33-3

  • Route#2

    Cas:106-43-4
    Cas:547-63-7
    Cas:1000536-33-3