D77001
己二腈
99%
别名:
1,6-hexanedinitrile, ADN, 1，4-二氰基丁烷
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线性分子式:
NC(CH2)4CN
化学文摘社编号:
分子量:
108.14
UNSPSC Code:
12352100
NACRES:
NA.22
PubChem Substance ID:
EC Number:
203-896-3
Beilstein/REAXYS Number:
1740005
MDL number:
Assay:
99%
Form:
liquid
InChI key
BTGRAWJCKBQKAO-UHFFFAOYSA-N
InChI
1S/C6H8N2/c7-5-3-1-2-4-6-8/h1-4H2
SMILES string
N#CCCCCC#N
vapor density
3.7 (vs air)
vapor pressure
0.01 mmHg ( 40 °C)
assay
99%
form
liquid
autoignition temp.
1022 °F
expl. lim.
4.99 %
Quality Level
bp
295 °C (lit.)
mp
1-3 °C (lit.)
density
0.951 g/mL at 25 °C (lit.)
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Application
己二腈是制造尼龙-6,6的关键前体。 它可以进行催化氢化以形成六亚甲基二胺（HMD）。 由于其高阳极和热稳定性，ADN非常有潜力作为高压锂电池中电解质溶液的溶剂。
signalword
Danger
hcodes
Hazard Classifications
Acute Tox. 3 Oral - Acute Tox. 4 Inhalation
存储类别
6.1C - Combustible acute toxic Cat.3 / toxic compounds or compounds which causing chronic effects
wgk
WGK 1
flash_point_f
325.4 °F - closed cup
flash_point_c
163 °C - closed cup
ppe
Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter
法规信息
危险化学品
此项目有
J L Moreau et al.
The Analyst, 116(12), 1381-1383 (1991-12-01)
A procedure for the assay of nitrile hydratase and amidase activities by high-performance liquid chromatography is described. The method can be used to assay the intermediate compounds resulting from the hydrolysis of adiponitrile to adipic acid, and to determine the
J L Moreau et al.
Journal of chromatography. B, Biomedical applications, 656(1), 197-202 (1994-06-03)
A procedure for the assay of nitrile hydratase and amidase activity by high-performance liquid chromatography is described. The method can be used to assay the intermediate compounds resulting from the hydrolysis of adiponitrile into adipic acid, and to determine the
Gerald L Kennedy
Drug and chemical toxicology, 27(2), 123-131 (2004-06-17)
Adiponitrile (ADN) has moderate acute toxicity with an oral LD50 in rats of 100 to 500 mg/kg and a 4-hr LC50 in rats of 1.71 mg/L (vapor plus aerosol). ADN produced slight eye but no skin irritation in rabbits. Repeated
The catalytic hydrogenation of adiponitrile to hexamethylenediamine over a rhodium/alumina catalyst in a three phase slurry reactor.
Alini S, et al.
J. Mol. Catal. A: Chem., 206(1-2), 363-370 (2003)
Soo-Jin Yeom et al.
The Biochemical journal, 415(3), 401-407 (2008-04-17)
Nitrilase from Rhodococcus rhodochrous ATCC 33278 hydrolyses both aliphatic and aromatic nitriles. Replacing Tyr-142 in the wild-type enzyme with the aromatic amino acid phenylalanine did not alter specificity for either substrate. However, the mutants containing non-polar aliphatic amino acids (alanine
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