ethylbenzene

Synonyms: "phenylethane", "ethylbenzol", "aethylbenzol", "ethylenzene", "ethyl benzene", "ethylbenzeen", "etilbenzene", "etylobenzen", "polyethylbenzene".

Source: Ethylbenzene is an important component of commercial gasoline and its surrogate fuels.

Identifiers:

IUPAC Name: ethylbenzene
CAS Number: 100-41-4
PubChem ID: 7500
InChiKey: YNQLUTRBYVCPMQ-UHFFFAOYSA-N
Canonical SMILES: CCC1=CC=CC=C1

Structural Properties:

Molecular Formula: C₈H_{10 _{Molecular Weight: 106.168}}

Pharmacophore Features:

Number of bond donors: 0
Number of bond acceptors: 0
Number of atoms different from hydrogen: 8

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Evidence Supporting This Chemical as an Endocrine Disruptor
TEDX List of Potential Endocrine Disruptors

National Toxicology Program. 1999. NTP Toxicology and Carcinogenesis Studies of Ethylbenzene (CAS No. 100-41-4) in F344/N Rats and B6C3F1 Mice (Inhalation Studies). Natl Toxicol Program Tech Rep Ser 466:1-231. URL: https://ntp.niehs.nih.gov/results/pubs/longterm/ reports/longterm/tr400499/abstracts/tr466/index.html.