Cas no 57774-36-4 (4-(4-Chlorophenyl)benzonitrile)
4-(4-Chlorophenyl)benzonitrile is a biphenyl derivative featuring a chlorophenyl group and a benzonitrile moiety, making it a versatile intermediate in organic synthesis. Its rigid aromatic structure and polar nitrile group enhance reactivity in cross-coupling reactions, such as Suzuki or Heck couplings, facilitating the construction of complex molecular frameworks. The electron-withdrawing chlorine substituent further modulates electronic properties, improving selectivity in electrophilic substitutions. This compound is particularly valuable in pharmaceutical and agrochemical research, where it serves as a precursor for bioactive molecules. High purity and stability under standard conditions ensure consistent performance in synthetic applications.
57774-36-4 structure
Product Name:4-(4-Chlorophenyl)benzonitrile
CAS No:57774-36-4
MF:C13H8ClN
MW:213.662322044373
MDL:MFCD05980153
CID:57187
PubChem ID:1394308
Update Time:2025-10-14
4-(4-Chlorophenyl)benzonitrile Chemical and Physical Properties
Names and Identifiers
-
- 4'-Chloro-[1,1'-biphenyl]-4-carbonitrile
- 4-(4-chlorophenyl)benzonitrile
- 4'-chloro[1,1'-biphenyl]-4-carbonitrile
- 4'-CHLORO-4-CYANOBIPHENYL
- 4-(4'-chlorophenyl)benzonitrile
- 4'-chloro-(1,1'-biphenyl)-4-carbonitrile
- 4'-chloro-biphenyl-4-carbonitrile
- 4-cyano-4'-chlorobiphenyl
- CS-0192392
- MFCD05980153
- AKOS002683481
- DVLCPRBAOHXYIQ-UHFFFAOYSA-N
- DTXSID50362746
- E89814
- 4-(4-chlorophenyl)benzenecarbonitrile
- A831595
- 57774-36-4
- BB 0222994
- BS-28921
- FT-0654704
- 4'-chlorobiphenyl-4-carbonitrile
- SCHEMBL4446050
- DB-412183
- 4-(4-Chlorophenyl)benzonitrile
-
- MDL： MFCD05980153
- Inchi： 1S/C13H8ClN/c14-13-7-5-12(6-8-13)11-3-1-10(9-15)2-4-11/h1-8H
- InChI Key： DVLCPRBAOHXYIQ-UHFFFAOYSA-N
- SMILES： ClC1C=CC(=CC=1)C1C=CC(C#N)=CC=1
Computed Properties
- Exact Mass: 213.03500
- Monoisotopic Mass: 213.035
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 15
- Rotatable Bond Count: 1
- Complexity: 239
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 4.7
- Topological Polar Surface Area: 23.8A^2
Experimental Properties
- Density: 1.24
- Boiling Point: 359.8°C at 760 mmHg
- Flash Point: 156.4°C
- Refractive Index: 1.628
- PSA: 23.79000
- LogP: 3.87868
4-(4-Chlorophenyl)benzonitrile Customs Data
- HS CODE：2926909090
- Customs Data：
China Customs Code:
2926909090Overview:
2926909090 Other nitrile based compounds. VAT:17.0% Tax refund rate:9.0% Regulatory conditions:nothing MFN tariff:6.5% general tariff:30.0%
Declaration elements:
Product Name, component content, use to
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%
4-(4-Chlorophenyl)benzonitrile Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| Alichem | A019107828-5g |
4'-Chloro-[1,1'-biphenyl]-4-carbonitrile |
57774-36-4 | 95% | 5g |
$497.04 | 2023-09-01 | |
| TRC | C428193-100mg |
4-(4-Chlorophenyl)benzonitrile |
57774-36-4 | 100mg |
$81.00 | 2023-05-18 | ||
| TRC | C428193-250mg |
4-(4-Chlorophenyl)benzonitrile |
57774-36-4 | 250mg |
$155.00 | 2023-05-18 | ||
| TRC | C428193-500mg |
4-(4-Chlorophenyl)benzonitrile |
57774-36-4 | 500mg |
$236.00 | 2023-05-18 | ||
| TRC | C428193-1g |
4-(4-Chlorophenyl)benzonitrile |
57774-36-4 | 1g |
$333.00 | 2023-05-18 | ||
| SHANG HAI HAO HONG Biomedical Technology Co., Ltd. | 1263062-1g |
4'-Chloro-[1,1'-biphenyl]-4-carbonitrile |
57774-36-4 | 97% | 1g |
￥1328.00 | 2024-05-08 | |
| Crysdot LLC | CD12059184-5g |
4'-Chloro-[1,1'-biphenyl]-4-carbonitrile |
57774-36-4 | 95+% | 5g |
$452 | 2024-07-24 | |
| A2B Chem LLC | AG64805-100mg |
4-(4-Chlorophenyl)benzonitrile |
57774-36-4 | 97% | 100mg |
$25.00 | 2023-12-30 | |
| A2B Chem LLC | AG64805-250mg |
4-(4-Chlorophenyl)benzonitrile |
57774-36-4 | 97% | 250mg |
$41.00 | 2023-12-30 | |
| A2B Chem LLC | AG64805-1g |
4-(4-Chlorophenyl)benzonitrile |
57774-36-4 | 97% | 1g |
$142.00 | 2024-04-19 |
4-(4-Chlorophenyl)benzonitrile Suppliers
Amadis Chemical Company Limited
Gold Member
Audited Supplier
(CAS:57774-36-4)4-(4-Chlorophenyl)benzonitrile
Order Number:A831595
Stock Status:in Stock
Quantity:5g/10g/25g
Purity:99%
Pricing Information Last Updated:Monday, 2 September 2024 15:23
Price ($):362.0/593.0/1135.0
Email:[email protected]
4-(4-Chlorophenyl)benzonitrile Related Literature
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Helga Garcia,Rui Ferreira,Marija Petkovic,Jamie L. Ferguson,Maria C. Leit?o,H. Q. Nimal Gunaratne,Luís Paulo N. Rebelo Green Chem., 2010,12, 367-369
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M. Zeiger,N. J?ckel,P. Strubel,L. Borchardt,R. Reinhold,W. Nickel,J. Eckert,V. Presser,S. Kaskel J. Mater. Chem. A, 2015,3, 17983-17990
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Joo Chuan Yeo,Kenry Lab Chip, 2016,16, 4082-4090
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Jing Yu,Yu-Qi Lyu,Jiapeng Liu,Mohammed B. Effat,Junxiong Wu J. Mater. Chem. A, 2019,7, 17995-18002
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Bo Wei,Zhenyu Liu,Chen Xie,Shu Yang,Wentao Tang,Aiwei Gu,Wing-Tak Wong,Ka-Leung Wong J. Mater. Chem. C, 2015,3, 12322-12327
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Recommended suppliers
Amadis Chemical Company Limited
(CAS:57774-36-4)4-(4-Chlorophenyl)benzonitrile
Purity:99%/99%/99%
Quantity:5g/10g/25g
Price ($):362.0/593.0/1135.0