3-(dibutylamino)propionitrile

Modify Date: 2025-08-29 22:59:51

3-(dibutylamino)propionitrile Structure
3-(dibutylamino)propionitrile structure
Common Name 3-(dibutylamino)propionitrile
CAS Number 25726-99-2 Molecular Weight 182.30600
Density 0.8513 Boiling Point 120ºC (10 mmHg)
Molecular Formula C11H22N2 Melting Point N/A
MSDS N/A Flash Point 110.8ºC

 Names

Name 3-(dibutylamino)propanenitrile
Synonym More Synonyms

 Chemical & Physical Properties

Density 0.8513
Boiling Point 120ºC (10 mmHg)
Molecular Formula C11H22N2
Molecular Weight 182.30600
Flash Point 110.8ºC
Exact Mass 182.17800
PSA 27.03000
LogP 2.80228
Vapour Pressure 0.00251mmHg at 25°C
Index of Refraction 1.44-1.444
InChIKey XNHGXTPCDNEDCH-UHFFFAOYSA-N
SMILES CCCCN(CCC#N)CCCC

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
UG0525000
CHEMICAL NAME :
Propionitrile, 3-amino-N,N-dibutyl-
CAS REGISTRY NUMBER :
25726-99-2
BEILSTEIN REFERENCE NO. :
1705000
LAST UPDATED :
199612
DATA ITEMS CITED :
2
MOLECULAR FORMULA :
C11-H22-N2
MOLECULAR WEIGHT :
182.35
WISWESSER LINE NOTATION :
NC2N4&4

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 :
3250 uL/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
AIHAAP American Industrial Hygiene Association Journal. (AIHA, 475 Wolf Ledges Pkwy., Akron, OH 44311) V.19- 1958- Volume(issue)/page/year: 30,470,1969
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Administration onto the skin
SPECIES OBSERVED :
Rodent - rabbit
DOSE/DURATION :
5040 uL/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
AIHAAP American Industrial Hygiene Association Journal. (AIHA, 475 Wolf Ledges Pkwy., Akron, OH 44311) V.19- 1958- Volume(issue)/page/year: 30,470,1969

 Safety Information

Hazard Codes Xi
Risk Phrases R36/37/38
Safety Phrases S24/25
HS Code 2926909090

 Customs

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%

 Synonyms

3-Dibutylamino-propionsaeure-nitril
EINECS 247-211-6
3-Dibutylamino-propionitril
N,N-Dibutyl-3-aminopropionitrile
MFCD00019864
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