Benzeneacetic acid,-alpha--ethyl-4-methyl- (9CI)

Modify Date: 2025-09-18 18:41:00

Benzeneacetic acid,-alpha--ethyl-4-methyl- (9CI) Structure
Benzeneacetic acid,-alpha--ethyl-4-methyl- (9CI) structure
Common Name Benzeneacetic acid,-alpha--ethyl-4-methyl- (9CI)
CAS Number 68692-82-0 Molecular Weight 178.22800
Density 1.067g/cm3 Boiling Point 293.6ºC at 760 mmHg
Molecular Formula C11H14O2 Melting Point N/A
MSDS N/A Flash Point N/A

 Names

Name 2-(4-methylphenyl)butanoic acid
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.067g/cm3
Boiling Point 293.6ºC at 760 mmHg
Molecular Formula C11H14O2
Molecular Weight 178.22800
Exact Mass 178.09900
PSA 37.30000
LogP 2.57320
Index of Refraction 1.528
InChIKey RTJXQMWCVNVYIW-UHFFFAOYSA-N
SMILES CCC(C(=O)O)c1ccc(C)cc1
Storage condition Store at room temperature

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
ET6550000
CHEMICAL NAME :
Butyric acid, 2-(p-tolyl)-
CAS REGISTRY NUMBER :
68692-82-0
BEILSTEIN REFERENCE NO. :
2209874
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C11-H14-O2
MOLECULAR WEIGHT :
178.25
WISWESSER LINE NOTATION :
QVY2&R D1

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
1350 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
FRPSAX Farmaco, Edizione Scientifica. (Casella Postale 227, 27100 Pavia, Italy) V.8-43 1953-88 For publisher information, see FRMCE8 Volume(issue)/page/year: 13,286,1958

 Synonyms

2-p-tolyl-butyric acid
Aethyl-p-tolyl-essigsaeure
2-p-Tolyl-buttersaeure
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