1-Phenyl-1-cyclohexanecarbonitrile
- Product Name
- 1-Phenyl-1-cyclohexanecarbonitrile
- CAS No.
- 2201-23-2
- Chemical Name
- 1-Phenyl-1-cyclohexanecarbonitrile
- Synonyms
- AKOS BBS-00005316;1-Phenylcyclohexan-carbonitrile;1-phenylcyclohexanecarbonitrile;1-PHENYL-1-CYCLOHEXANECARBONITRILE;Cyclohexanecarbonitrile, 1-phenyl-;1-Phenylcyclohexane-1-carbonitrile;1-Phenylcyclohexanecarbonitrile >1-Phenyl-1-cyclohexanecarbonitrile,97%;1-PHENYL-1-CYCLOHEXANECARBONITRILE 97%
- CBNumber
- CB6276104
- Molecular Formula
- C13H15N
- Formula Weight
- 185.26
- MOL File
- 2201-23-2.mol
1-Phenyl-1-cyclohexanecarbonitrile Property
- Boiling point:
- 141°C/7mmHg(lit.)
- Density
- 1.01
- refractive index
- 1.5332-1.5352
- Flash point:
- 121°
- storage temp.
- Sealed in dry,Room Temperature
- form
- clear liquid
- color
- Colorless to Light yellow to Light orange
- InChI
- InChI=1S/C13H15N/c14-11-13(9-5-2-6-10-13)12-7-3-1-4-8-12/h1,3-4,7-8H,2,5-6,9-10H2
- InChIKey
- AUXIEQKHXAYAHG-UHFFFAOYSA-N
- SMILES
- C1(C2=CC=CC=C2)(C#N)CCCCC1
- NIST Chemistry Reference
- 1-Phenyl-1-cyclohexanecarbonitrile(2201-23-2)
Safety
- Hazard Codes
- Xn
- Risk Statements
- 36/37/38-20/21/22
- Safety Statements
- 36/37/39-26
- RIDADR
- UN 3276 6.1/PG III
- HazardClass
- 6.1
- PackingGroup
- III
- HS Code
- 29269095
Hazard and Precautionary Statements (GHS)
- Symbol(GHS)
-
- Signal word
- Danger
- Hazard statements
-
H301Toxic if swalloed
- Precautionary statements
-
P264Wash hands thoroughly after handling.
P264Wash skin thouroughly after handling.
P270Do not eat, drink or smoke when using this product.
P301+P310IF SWALLOWED: Immediately call a POISON CENTER or doctor/physician.
P321Specific treatment (see … on this label).
P330Rinse mouth.
P405Store locked up.
P501Dispose of contents/container to..…
N-Bromosuccinimide Price
- Product number
- P2253
- Product name
- 1-Phenylcyclohexanecarbonitrile
- Purity
- >97.0%(GC)
- Packaging
- 5g
- Price
- $99
- Updated
- 2025/07/31
- Product number
- P2253
- Product name
- 1-Phenylcyclohexanecarbonitrile
- Purity
- >97.0%(GC)
- Packaging
- 25g
- Price
- $296
- Updated
- 2022/04/27
- Product number
- P336633
- Product name
- 1-Phenyl-1-cyclohexanecarbonitrile
- Packaging
- 50mg
- Price
- $45
- Updated
- 2021/12/16
- Product number
- P336633
- Product name
- 1-Phenyl-1-cyclohexanecarbonitrile
- Packaging
- 100mg
- Price
- $60
- Updated
- 2021/12/16
- Product number
- 1140AB
- Product name
- 1-Phenylcyclohexanecarbonitrile
- Packaging
- 25g
- Price
- $477
- Updated
- 2021/12/16
1-Phenyl-1-cyclohexanecarbonitrile Chemical Properties,Usage,Production
Chemical Properties
CLEAR COLOURLESS TO PALE BROWN LIQUID
Synthesis
111-24-0
140-29-4
2201-23-2
GENERAL STEPS: A mixture of benzeneacetonitrile (50.0 g, 426.8 mmol) and 1,5-dibromopentane (58.1 mL, 426.8 mmol) was added slowly and dropwise to a dimethylsulfoxide (600.0 mL) suspension of NaH (42.7 g, 1067.0 mmol, 60%) at 0 °C. The mixture was pre-dissolved in a solvent mixture of dimethyl sulfoxide and ether (1:1, 200.0 mL). After dropwise addition, the reaction mixture was continued to be stirred at 0°C for 2 hours. Upon completion of the reaction, water and 10% HCl solution were added to the mixture, followed by extraction with ethyl acetate. The organic layers were combined, washed sequentially with water and brine and dried over anhydrous sodium sulfate. The solvent was removed by concentration under reduced pressure to give the crude product. The crude product was purified by conventional silica gel column chromatography (eluent: hexane) to afford 1-phenyl-1-cyclohexanecarbonitrile (52.0 g, yield 65.76%) as a colorless oil.GC-MS analysis showed that the molecular ion peak m/z was 185.0.
References
[1] Patent: US2014/194431, 2014, A1. Location in patent: Paragraph 0940-0942
[2] Bioorganic and Medicinal Chemistry, 2015, vol. 23, # 14, p. 3913 - 3924
[3] Journal of Organic Chemistry, 1971, vol. 36, p. 1308 - 1309
[4] Chemische Berichte, 1973, vol. 106, p. 2890 - 2903
[5] Bulletin de la Societe Chimique de France, 1965, p. 2030 - 2037
1-Phenyl-1-cyclohexanecarbonitrile Preparation Products And Raw materials
Raw materials
Preparation Products
1-Phenyl-1-cyclohexanecarbonitrile Suppliers
- Tel
- 022-83946278 13820503911
- Fax
- 022-83945176
- sales@creasyn.com
- Country
- China
- ProdList
- 958
- Advantage
- 68
- Tel
- 18210857532; 18210857532
- Fax
- 86-10-82849933
- jkinfo@jkchemical.com
- Country
- China
- ProdList
- 96815
- Advantage
- 76
- Tel
- 4006356688 18621169109
- Fax
- 86-21-61259102
- market03@meryer.com
- Country
- China
- ProdList
- 40228
- Advantage
- 62
- Tel
- 025-85760892 13376080562
- Fax
- 025-85766769
- sales@habotech.com
- Country
- China
- ProdList
- 884
- Advantage
- 60
- Tel
- 4009903999 13355009207
- Fax
- 0539-6365991
- 3007715519@qq.com
- Country
- China
- ProdList
- 18729
- Advantage
- 57
- Tel
- +86 (573) 82222445 (0)18006601000 452520369
- Fax
- +86 (573) 82222643
- sales@maya-r.com
- Country
- China
- ProdList
- 11707
- Advantage
- 57
- Tel
- 03-36680489
- Fax
- 03-3668-0520
- Sales-JP@TCIchemicals.com
- Country
- Japan
- ProdList
- 28387
- Advantage
- 80
- Tel
- 400-6206333 13167063860
- Fax
- 021-50323701
- anhua.mao@aladdin-e.com
- Country
- China
- ProdList
- 25003
- Advantage
- 65
- Tel
- 022-022-23301225 18202662021
- Fax
- 022-25541300
- Mingmingxuetsu@163.com
- Country
- China
- ProdList
- 313
- Advantage
- 56
- Tel
- 15121041756
- xingui2022@126.com
- Country
- China
- ProdList
- 9979
- Advantage
- 58