13361-53-0

13361-53-0 structure

13361-53-0 structure

Name: hexyl cyanoacetate
Chemical Name: hexyl 2-cyanoacetate
CAS Number: 13361-53-0
Molecular Formula: C₉H₁₅NO₂
Molecular Weight: 169.22100
Create Date: 2016-09-21 16:34:47
Modify Date: 2024-01-06 21:16:13

Name	hexyl 2-cyanoacetate
Synonyms	cyanoacetic acid hexyl ester ACETIC ACID,CYANO-,HEXYL ESTER hexyl cyanoacetate EINECS 236-426-0 n-hexyl cyanoacetate Acetic acid,2-cyano-,hexyl ester Cyanessigsaeure-hexylester

Density	0.972g/cm3
Boiling Point	228.7ºC at 760mmHg
Molecular Formula	C₉H₁₅NO₂
Molecular Weight	169.22100
Flash Point	98.2ºC
Exact Mass	169.11000
PSA	50.09000
LogP	2.02358
Vapour Pressure	0.0724mmHg at 25°C
Index of Refraction	1.435
Storage condition	2-8℃

CHEMICAL IDENTIFICATION

RTECS NUMBER :: AG4150000

CHEMICAL NAME :: Acetic acid, cyano-, hexyl ester

CAS REGISTRY NUMBER :: 13361-53-0

LAST UPDATED :: 199612

DATA ITEMS CITED :: 1

MOLECULAR FORMULA :: C9-H15-N-O2

MOLECULAR WEIGHT :: 169.25

WISWESSER LINE NOTATION :: NC1VO6

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :: LD50 - Lethal dose, 50 percent kill

ROUTE OF EXPOSURE :: Oral

SPECIES OBSERVED :: Rodent - rat

DOSE/DURATION :: 6440 mg/kg

TOXIC EFFECTS :: Peripheral Nerve and Sensation - flaccid paralysis without anesthesia (usually neuromuscular blockage) Sense Organs and Special Senses (Olfaction) - ulcerated nasal septum Behavioral - somnolence (general depressed activity)

REFERENCE :: LONZA# Personal Communication from LONZA Ltd., CH-4002, Basel, Switzerland Volume(issue)/page/year: 13FEB1981

Risk Phrases	20/21/22-36/37/38
Safety Phrases	26-37/39

Precursor 2
105-56-6 111-27-3
DownStream 0