Dayang Chem (Hangzhou) Co., Ltd.
China
Product Name: Heptanedinitrile, 4-benzoyl-4- (2-cyanoethyl)-
Price: $Inquiry/100g $Inquiry/1kg $Inquiry/100kg $Inquiry/1000kg
Purity: 98.0%
Stocking Period: Inquiry
Contact: Ms Wang

5342-96-1

5342-96-1 structure

Name: Heptanedinitrile, 4-benzoyl-4- (2-cyanoethyl)-
Chemical Name: 4-benzoyl-4-(2-cyanoethyl)heptanedinitrile
CAS Number: 5342-96-1
Molecular Formula: C₁₇H₁₇N₃O
Molecular Weight: 279.33600
Create Date: 2018-11-23 17:58:14
Modify Date: 2024-01-03 11:10:48

Name	4-benzoyl-4-(2-cyanoethyl)heptanedinitrile
Synonyms	Propionitrile,phenacylidynetri Phenacylidynetripropionitrile 2,2,2-tris(2-cyanoethyl)acetophenone Tris(cyanoethyl)acetophenone Heptanedinitrile,4-benzoyl-4-(2-cyanoethyl)-(6CI,9CI) 4-(2-Cyan-aethyl)-4-benzoyl-heptandisaeure-dinitril 4-Benzoyl-4-(2-cyan-aethyl)-heptandinitril 4-benzoyl-4(2-cyanoethyl)heptanedinitrile

Density	1.118g/cm3
Boiling Point	571ºC at 760 mmHg
Molecular Formula	C₁₇H₁₇N₃O
Molecular Weight	279.33600
Flash Point	299.1ºC
Exact Mass	279.13700
PSA	88.44000
LogP	3.76704
Index of Refraction	1.534

CHEMICAL IDENTIFICATION

RTECS NUMBER :: UG4280000

CHEMICAL NAME :: Propionitrile, phenacylidynetri-

CAS REGISTRY NUMBER :: 5342-96-1

BEILSTEIN REFERENCE NO. :: 2144045

LAST UPDATED :: 199712

DATA ITEMS CITED :: 1

MOLECULAR FORMULA :: C17-H17-N3-O

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 :: 100 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#03282

HS Code	2926909090

107-13-1

98-86-2

~46%

100869-93-0

5342-96-1

Literature: Jaitak, Vikas; Kaul; Das, Pralay Indian Journal of Chemistry - Section B Organic and Medicinal Chemistry, 2013 , vol. 52, # 8 p. 1137 - 1145

107-13-1

98-86-2

5342-96-1

Literature: Bruson; Riener Journal of the American Chemical Society, 1942 , vol. 64, p. 2857 Journal of the American Chemical Society, 1943 , vol. 65, p. 21

107-13-1

98-86-2

~39%

100869-93-0

5342-96-1

Detail

Literature: Jaitak, Vikas; Bandna; Das, Pralay; Kaul; Singh, Bikram; Kumar, Neeraj Synthetic Communications, 2011 , vol. 41, # 18 p. 2727 - 2737

123-91-1

107-13-1

98-86-2

5342-96-1

Literature: Bruson; Riener Journal of the American Chemical Society, 1942 , vol. 64, p. 2857 Journal of the American Chemical Society, 1943 , vol. 65, p. 21

Precursor 3
107-13-1 98-86-2 123-91-1
DownStream 2
10413-00-0 100869-93-0

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%

5342-96-1	126-50-1
85136-56-7	154590-46-2
85536-95-4	71033-14-2
68227-58-7	59527-99-0
81367-79-5	75631-35-5
2892064-88-7	1158522-08-7
940364-43-2	2103909-10-8
134104-43-1	131615-57-1
6906-52-1	930439-75-1
1018584-77-4	1375289-11-4