4-methylpentanenitrile

Modify Date: 2025-08-21 19:30:17

4-methylpentanenitrile structure	Common Name	4-methylpentanenitrile
	CAS Number	542-54-1	Molecular Weight	97.15820
	Density	0.8009 g/cm3 (20 ºC)	Boiling Point	156.5 ºC
	Molecular Formula	C₆H₁₁N	Melting Point	-51 ºC
	MSDS	N/A	Flash Point	45.6±0.0 ºC

Name	4-methylpentanenitrile
Synonym	More Synonyms

Density	0.8009 g/cm3 (20 ºC)
Boiling Point	156.5 ºC
Melting Point	-51 ºC
Molecular Formula	C₆H₁₁N
Molecular Weight	97.15820
Flash Point	45.6±0.0 ºC
Exact Mass	97.08910
PSA	23.79000
LogP	1.94618
Index of Refraction	1.4048 (589.3 nm 22 ºC)

4-methylpentanenitrile MSDS(Chinese)

CHEMICAL IDENTIFICATION

RTECS NUMBER :: YV8588000

CHEMICAL NAME :: Valeronitrile, 4-methyl-

CAS REGISTRY NUMBER :: 542-54-1

BEILSTEIN REFERENCE NO. :: 1698246

LAST UPDATED :: 199701

DATA ITEMS CITED :: 4

MOLECULAR FORMULA :: C6-H11-N

MOLECULAR WEIGHT :: 97.18

WISWESSER LINE NOTATION :: NC2Y1&1

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

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

ROUTE OF EXPOSURE :: Oral

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 488 mg/kg

TOXIC EFFECTS :: Details of toxic effects not reported other than lethal dose value

REFERENCE :: NEZAAQ Nippon Eiseigaku Zasshi. Japanese Journal of Hygiene. (Nippon Eisei Gakkai, c/o Kyoto Daigaku Igakubu, Konoe-cho, Yoshida, Sakyo-ku, Kyoto 606, Japan) V.1- 1946- Volume(issue)/page/year: 39,423,1984

TYPE OF TEST :: LDLo - Lowest published lethal dose

ROUTE OF EXPOSURE :: Subcutaneous

SPECIES OBSERVED :: Rodent - rabbit

DOSE/DURATION :: 89 mg/kg

TOXIC EFFECTS :: Behavioral - tremor Lungs, Thorax, or Respiration - dyspnea

REFERENCE :: AIPTAK Archives Internationales de Pharmacodynamie et de Therapie. (Heymans Institute of Pharmacology, De Pintelaan 185, B-9000 Ghent, Belgium) V.4- 1898- Volume(issue)/page/year: 5,161,1899

TYPE OF TEST :: LDLo - Lowest published lethal dose

ROUTE OF EXPOSURE :: Subcutaneous

SPECIES OBSERVED :: Amphibian - frog

DOSE/DURATION :: 1600 mg/kg

TOXIC EFFECTS :: Peripheral Nerve and Sensation - spastic paralysis with or without sensory change Cardiac - other changes Lungs, Thorax, or Respiration - respiratory depression

REFERENCE :: AIPTAK Archives Internationales de Pharmacodynamie et de Therapie. (Heymans Institute of Pharmacology, De Pintelaan 185, B-9000 Ghent, Belgium) V.4- 1898- Volume(issue)/page/year: 5,161,1899

Risk Phrases	10-23/24/25
Safety Phrases	16-26-36/37/39
RIDADR	1992
RTECS	YV8588000
Packaging Group	III
Hazard Class	3.2
HS Code	2926909090

Precursor 10
CAS#:107-82-4 Isoamyl bromide CAS#:151-50-8 POTASSIUM CYANIDE CAS#:78-77-3 1-Bromo-2-methy... CAS#:75-05-8 Acetonitrile
CAS#:1119-15-9 4-methylpent-2-... CAS#:75917-29-2 2-propylazodiph... CAS#:107-13-1 Acrylonitrile CAS#:10285-87-7 Formamide,N-(3-...
CAS#:6140-61-0 Pentanenitrile,... CAS#:107-10-8 Propylamine
DownStream 10
CAS#:1119-29-5 Pentanamide, 4-... CAS#:2999-14-6 4-methyl-1-(2,4... CAS#:78-78-4 isopentane CAS#:646-07-1 4-Methylpentano...
CAS#:626-89-1 4-Methyl-1-pentanol CAS#:101948-24-7 methyl 4-methyl... CAS#:1119-16-0 4-Methylpentanal CAS#:107-83-5 isohexane
CAS#:5344-20-7 Isohexylamine CAS#:54775-00-7 4-Methyl-N-(4-m...

HS Code	2926909090
Summary	HS:2926909090 other nitrile-function compounds VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:30.0%

isobutyl acetonitrile

Pentanenitrile,4-methyl

Isoamyl cyanide

Isocapronitrile

4-methylpentanenitile

4-methylvaleronitrile

4-methylpentanitrile

Isoamylkyanid [Czech]

Isopentyl cyanide

EINECS 208-817-6

Valeronitrile,4-methyl

Pentanenitrile,4-methyl-

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Shanghai Nianxing Industrial Co., Ltd
China
Product Name: 4-methylpentanenitrile
Price: Check
Purity: 98.0%
Delivery: 10 Day
Contact: Yang
Email: sales@echemcloud.com

Dayang Chem (Hangzhou) Co., Ltd.
China
Product Name: Pentanenitrile,4-methyl-
Price: $Inquiry/100g $Inquiry/1kg $Inquiry/100kg $Inquiry/1000kg
Purity: 98.0%
Delivery: Inquiry
Contact: Ms Wang
Email: enquiry@dycnchem.com

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4-methylpentanenitrile

Names

Chemical & Physical Properties

MSDS

Toxicological Information

CHEMICAL IDENTIFICATION

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

Safety Information

Precursor & DownStream

Customs

Synonyms

The content on this webpage is sourced from various professional data sources. If you have any questions or concerns regarding the content, please feel free to contact service1@chemsrc.com.