1-Piperidinebutyronitrile

Modify Date: 2025-09-14 08:41:31

1-Piperidinebutyronitrile Structure
1-Piperidinebutyronitrile structure
Common Name 1-Piperidinebutyronitrile
CAS Number 4672-18-8 Molecular Weight 152.23700
Density 0.942g/cm3 Boiling Point 268.8ºC at 760 mmHg
Molecular Formula C9H16N2 Melting Point N/A
MSDS N/A Flash Point 109.6ºC

 Names

Name 1-Piperidinebutyronitrile
Synonym More Synonyms

 Chemical & Physical Properties

Density 0.942g/cm3
Boiling Point 268.8ºC at 760 mmHg
Molecular Formula C9H16N2
Molecular Weight 152.23700
Flash Point 109.6ºC
Exact Mass 152.13100
PSA 27.03000
LogP 1.71398
Index of Refraction 1.47
InChIKey CVROVTGNNDIZNS-UHFFFAOYSA-N
SMILES N#CCCCN1CCCCC1

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
TM5630000
CHEMICAL NAME :
1-Piperidinebutyronitrile
CAS REGISTRY NUMBER :
4672-18-8
BEILSTEIN REFERENCE NO. :
0110495
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C9-H16-N2
MOLECULAR WEIGHT :
152.27
WISWESSER LINE NOTATION :
T6NTJ A3CN

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intravenous
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
18 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
CSLNX* U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. (Aberdeen Proving Ground, MD 21010) Volume(issue)/page/year: NX#07823

 Safety Information

HS Code 2933399090

 Synthetic Route

~96%

1-Piperidinebutyronitrile Structure

1-Piperidinebut...

CAS#:4672-18-8

Literature: WYETH; SIENA BIOTECH S.P.A. Patent: US2010/16598 A1, 2010 ; Location in patent: Page/Page column 26-27 ;

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1-Piperidinebutyronitrile Structure

1-Piperidinebut...

CAS#:4672-18-8

Literature: Blank Chemische Berichte, 1892 , vol. 25, p. 3044

 Customs

HS Code 2933399090
Summary 2933399090. other compounds containing an unfused pyridine ring (whether or not hydrogenated) in the structure. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

 Synonyms

Methyl 4-(piperidin-1-yl)benzoate
4-piperidino-butyronitrile
methyl 4-piperidylbenzoate
4-piperidin-1-yl-benzoic acid methyl ester
1-Piperidinebutanenitrile
4-Piperidino-benzoesaeure-methylester
4-Piperidino-butyronitril
4-(piperidin-1-yl)butyronitrile
methylpiperidinobenzenecarboxylate
4-piperidin-1-yl-butanenitrile
Methyl 4-piperidinobenzenecarboxylate
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