| Identification | More | [Name]
3-Aminocrotononitrile | [CAS]
1118-61-2 | [Synonyms]
3-AMINO-2-BUTENENITRILE
3-AMINO-2-BUTENONITRILE
3-AMINOCROTONITRILE
3-AMINOCROTONONITRILE
3-IMINOBUTYRONITRILE
BETA-AMINOCROTONONITRILE
DIACETONITRILE
(2E)-3-Amino-2-butenenitrile
3-amino-2-butenenitril
3-aminocrotononitrile,mixtureofcisandtrans
beta-Aminocrotonitrile
3-Aminocrotononitrile, (Diacetonitrile
Diacetonitrile~3-Iminobutyronitrile
3-Aminocrotononitrile, mixture of cis and trans
Diacetonitrile
3-AMINOCROTONONITRILE, 96%, MIXTURE OF C IS AND TRANS
p-Isopropyl phenylamine
β-Aminocrotonitrile
3-aminocrotononitrile, (e)+(z)
3-Amino-2-butenenitrile, 3-Iminobutyronitrile, Diacetonitrile
3-Amino-3-methacrylonitrile | [EINECS(EC#)]
214-266-2 | [Molecular Formula]
C4H6N2 | [MDL Number]
MFCD00008071 | [Molecular Weight]
82.1 | [MOL File]
1118-61-2.mol |
| Chemical Properties | Back Directory | [Appearance]
Yellowish flakes | [Melting point ]
79-81°C | [Boiling point ]
120°C 4mm | [density ]
0.952 | [refractive index ]
1.4449 (estimate) | [Fp ]
154°C | [storage temp. ]
2-8°C
| [solubility ]
95% ethanol: soluble25mg/mL, clear, colorless to yellow | [form ]
Flakes | [pka]
3.88±0.70(Predicted) | [color ]
Yellow | [Water Solubility ]
Very soluble in water, soluble in ethanol. | [Usage]
Diacetonitrile is used as intermediate for the syntheses of heterocycles (e.g. pyridines and pyrimidines) and for the production of polyurethane). It is used in the pharmaceutical (e.g. production of sulfsomizole) and dyestuff industries. Product Data Sheet | [BRN ]
1719815 | [InChI]
1S/C4H6N2/c1-4(6)2-3-5/h2H,6H2,1H3/b4-2+ | [InChIKey]
DELJOESCKJGFML-DUXPYHPUSA-N | [SMILES]
C\C(N)=C/C#N | [LogP]
0.005 (est) | [CAS DataBase Reference]
1118-61-2(CAS DataBase Reference) | [NIST Chemistry Reference]
2-Butenenitrile, 3-amino-(1118-61-2) | [EPA Substance Registry System]
1118-61-2(EPA Substance) |
| Safety Data | Back Directory | [Symbol(GHS) ]
GHS06 | [Signal word ]
Danger | [Hazard statements ]
H302-H311-H317 | [Precautionary statements ]
P261-P264-P270-P280-P301+P312-P302+P352+P312 | [Hazard Codes ]
Xn | [Risk Statements ]
R22:Harmful if swallowed.
R20/21/22:Harmful by inhalation, in contact with skin and if swallowed . | [Safety Statements ]
S22:Do not breathe dust .
S24/25:Avoid contact with skin and eyes .
S29:Do not empty into drains .
S36/37:Wear suitable protective clothing and gloves . | [RIDADR ]
UN 3439 6.1/PG 3
| [WGK Germany ]
3
| [TSCA ]
Yes | [PackingGroup ]
III | [HS Code ]
29269090 | [Storage Class]
6.1C - Combustible acute toxic Cat.3
toxic compounds or compounds which causing chronic effects | [Hazard Classifications]
Acute Tox. 3 Dermal
Acute Tox. 4 Oral
Skin Sens. 1 |
| Raw materials And Preparation Products | Back Directory | [Raw materials]
Phosphine oxide, bis(1-methylethyl)--->Lithium diethylamide-->5-Methylisoxazole | [Preparation Products]
3-Amino-5-methylpyrazole-->1,3-Dimethyl-1H-pyrazol-5-amine-->5-Bromo-1,3-dimethyl-1H-pyrazole-->5-Isothiocyanato-1,3-dimethyl-1H-pyrazole-->4-Chloro-1,3-dimethylpyrazolo[3,4-b]pyridine-5-carboxylic acid-->1H-Pyrazolo[3,4-b]pyridine-3-carboxylicacid(9CI)-->4-Chloro-1,3-dimethylpyrazolo[3,4-b]pyridine-5-carbonyl chloride-->Ethyl 4-chloro-1,3-dimethyl-1H-pyrazolo[3,4-b]pyridine-5-carboxylate-->1-methyltrimethylenediamine-->5-Methyl-1-phenyl-1H-[1, 2, 3]triazole-4-carboxylic acid-->2-(3,4-Dichloro-phenyl)-5-methyl-2H-pyrazol-3-ylamine-->1,4-Dihydro-2,4,6-trimethyl-3,5-pyridinedicarbonitrile-->3-Cyano-2-methyl-6-phenylpyridine-->Ethyl 5-cyano-6-methyl-2-(trifluoromethyl)nicotinate |
| Hazard Information | Back Directory | [Chemical Properties]
Yellowish flakes | [Uses]
3-Aminocrotononitrile is used as intermediate for the syntheses of heterocycles (e.g. pyridines and pyrimidines) and for the production of polyurethane). It is used in the pharmaceutical (e.g. production of sulfsomizole) and dyestuff industries. Product Data Sheet
| [Biochem/physiol Actions]
3-Aminocrotononitrile reacts with ferrocenyl-1,2-enones to form ferrocenyl pyridines. It undergoes diazotization coupling reaction with p-substituted anilines to give 2-arylhydrazone-3-ketimino-butyronitriles. |
|
| Company Name: |
J & K SCIENTIFIC LTD.
|
| Telephone: |
18210857532 18210857532 |
| Website: |
https://www.jkchemical.com |
| Company Name: |
Alfa Aesar
|
| Telephone: |
400-6106006 |
| Website: |
http://chemicals.thermofisher.cn |
| Company Name: |
Energy Chemical
|
| Telephone: |
400-0056266 |
| Website: |
www.energy-chemical.com |
|