Skip to Content
Merck
All Photos(1)

Key Documents

View All Documentation

332070

Sigma-Aldrich

(2,3-Epoxypropyl)benzene

98%

Synonym(s):

(Phenylmethyl)oxirane

Sign Into View Organizational & Contract Pricing
All Photos(1)

About This Item

Empirical Formula (Hill Notation):
C9H10O
CAS Number:
4436-24-2
Molecular Weight:
134.18
MDL number:
MFCD00074964
UNSPSC Code:
12162002
PubChem Substance ID:
24860022
NACRES:
NA.23

Quality Level

100

Assay

98%

form

liquid

refractive index

n20/D 1.523 (lit.)

bp

98-100 °C/17 mmHg (lit.)

density

1.02 g/mL at 25 °C (lit.)

SMILES string

C1OC1Cc2ccccc2

InChI

1S/C9H10O/c1-2-4-8(5-3-1)6-9-7-10-9/h1-5,9H,6-7H2

InChI key

JFDMLXYWGLECEY-UHFFFAOYSA-N

Related Categories

Pictograms

Exclamation mark
GHS07

Signal Word

Warning

Hazard Statements

H315,H319,H335

Hazard Classifications

Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3

Target Organs

Respiratory system

Storage Class Code

10 - Combustible liquids

WGK

WGK 3

Flash Point(F)

179.6 °F - closed cup

Flash Point(C)

82 °C - closed cup

Personal Protective Equipment

dust mask type N95 (US), Eyeshields, Gloves

Choose from one of the most recent versions:

Certificates of Analysis (COA)

Lot/Batch Number
0000373841
0000342358
0000342358
0000373841
0000224608

Don't see the Right Version?

If you require a particular version, you can look up a specific certificate by the Lot or Batch number.

Search for a COA

Already Own This Product?

Find documentation for the products that you have recently purchased in the Document Library.

Visit the Document Library

G Luo et al.
Drug metabolism and disposition: the biological fate of chemicals, 22(5), 731-737 (1994-09-01)
The enzymatic detoxication in vitro of the 2',3'-epoxide derivatives of allylbenzene and estragole was examined, and the relative rates of enzymatic glutathione conjugation and epoxide hydrolysis were compared with those for styrene 1',2'-oxide. HPLC was used to determine the amounts
G Luo et al.
Drug metabolism and disposition: the biological fate of chemicals, 24(9), 1020-1027 (1996-09-01)
Epoxidation at the allylic side chain is a major metabolic pathway for allylbenzene and its naturally occurring analogs safrole, estragole, and eugenol. We demonstrate herein that the epoxide metabolites of allylbenzene, estragole, and safrole can form covalent adducts with DNA
T M Guenthner et al.
Toxicology, 160(1-3), 47-58 (2001-03-14)
The genotoxic potential of naturally occurring allylbenzene analogs, including safrole, eugenol, estragole, and others, has been examined in many studies over the past 30 years. It has been established that these compounds are subject to biotransformation in the liver, which

Our team of scientists has experience in all areas of research including Life Science, Material Science, Chemical Synthesis, Chromatography, Analytical and many others.

Contact Technical Service