CAS 77-51-0|isoaminile

Introduction：Basic information about CAS 77-51-0|isoaminile, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.

Table of Contents

1. Names
2. Chemical & Physical Properties
3. Toxicological Information
CHEMICAL IDENTIFICATION
HEALTH HAZARD DATA
ACUTE TOXICITY DATA
4. Synonyms

Common Name	isoaminile
CAS Number	77-51-0	Molecular Weight	244.37500
Density	0.952g/cm3	Boiling Point	346.1ºC at 760mmHg
Molecular Formula	C₁₆H₂₄N₂	Melting Point	/
MSDS	/	Flash Point	136.2ºC

Names

Name	4-(dimethylamino)-2-phenyl-2-propan-2-ylpentanenitrile
Synonym	More Synonyms

Chemical & Physical Properties

Density	0.952g/cm3
Boiling Point	346.1ºC at 760mmHg
Molecular Formula	C₁₆H₂₄N₂
Molecular Weight	244.37500
Flash Point	136.2ºC
Exact Mass	244.19400
PSA	27.03000
LogP	3.44418
Index of Refraction	1.504
InChIKey	WFLSCFISQHLEED-UHFFFAOYSA-N
SMILES	CC(CC(C#N)(c1ccccc1)C(C)C)N(C)C
Storage condition	-196°C

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :: YV8520000

CHEMICAL NAME :: Valeronitrile, 4-(dimethylamino)-2-isopropyl-2-phenyl-

CAS REGISTRY NUMBER :: 77-51-0

LAST UPDATED :: 199707

DATA ITEMS CITED :: 5

MOLECULAR FORMULA :: C16-H24-N2

MOLECULAR WEIGHT :: 244.42

WISWESSER LINE NOTATION :: 1Y1&XR&CN&1Y1&N1&1

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :: LDLo - Lowest published lethal dose

ROUTE OF EXPOSURE :: Oral

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 378 mg/kg

TOXIC EFFECTS :: Behavioral - convulsions or effect on seizure threshold Lungs, Thorax, or Respiration - other changes

REFERENCE :: OYYAA2 Oyo Yakuri. Pharmacometrics. (Oyo Yakuri Kenkyukai, CPO Box 180, Sendai 980-91, Japan) V.1- 1967- Volume(issue)/page/year: 2,323,1968

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

ROUTE OF EXPOSURE :: Intraperitoneal

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 77 mg/kg

TOXIC EFFECTS :: Behavioral - convulsions or effect on seizure threshold Behavioral - ataxia Lungs, Thorax, or Respiration - other changes

REFERENCE :: OYYAA2 Oyo Yakuri. Pharmacometrics. (Oyo Yakuri Kenkyukai, CPO Box 180, Sendai 980-91, Japan) V.1- 1967- Volume(issue)/page/year: 2,323,1968

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

ROUTE OF EXPOSURE :: Subcutaneous

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 127 mg/kg

TOXIC EFFECTS :: Behavioral - convulsions or effect on seizure threshold Behavioral - ataxia Lungs, Thorax, or Respiration - other changes

REFERENCE :: OYYAA2 Oyo Yakuri. Pharmacometrics. (Oyo Yakuri Kenkyukai, CPO Box 180, Sendai 980-91, Japan) V.1- 1967- Volume(issue)/page/year: 2,323,1968

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

ROUTE OF EXPOSURE :: Intravenous

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 55 mg/kg

TOXIC EFFECTS :: Behavioral - convulsions or effect on seizure threshold Lungs, Thorax, or Respiration - other changes

REFERENCE :: OYYAA2 Oyo Yakuri. Pharmacometrics. (Oyo Yakuri Kenkyukai, CPO Box 180, Sendai 980-91, Japan) V.1- 1967- Volume(issue)/page/year: 2,323,1968

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

ROUTE OF EXPOSURE :: Intravenous

SPECIES OBSERVED :: Mammal - dog

DOSE/DURATION :: 48400 ug/kg

TOXIC EFFECTS :: Sense Organs and Special Senses (Eye) - mydriasis (pupillary dilation) Behavioral - convulsions or effect on seizure threshold

REFERENCE :: OYYAA2 Oyo Yakuri. Pharmacometrics. (Oyo Yakuri Kenkyukai, CPO Box 180, Sendai 980-91, Japan) V.1- 1967- Volume(issue)/page/year: 2,323,1968

Synonyms

Nullatuss

4-(Dimethylamino)-2-isopropyl-2-phenylvaleronitrile

Isoaminile

Isoaminilo [INN-Spanish]

EINECS 201-033-5

Isoaminil

Isoaminilum [INN-Latin]

Aprecon

Recommended......