Cas no 486455-27-0 (4-(3-Hydroxyphenyl)benzonitrile)
4-(3-Hydroxyphenyl)benzonitrile is a versatile aromatic compound featuring both hydroxyl and nitrile functional groups, making it valuable in organic synthesis and pharmaceutical intermediates. Its structural properties enable selective reactivity in cross-coupling reactions and derivatization. The compound exhibits stability under standard conditions, ensuring consistent performance in research and industrial applications.
486455-27-0 structure
Product Name:4-(3-Hydroxyphenyl)benzonitrile
CAS No:486455-27-0
MF:C13H9NO
MW:195.216663122177
MDL:MFCD05854257
CID:820717
PubChem ID:24883308
Update Time:2025-06-17
4-(3-Hydroxyphenyl)benzonitrile Chemical and Physical Properties
Names and Identifiers
-
- 4-(3-Hydroxyphenyl)benzonitrile
- 3'-HYDROXYBIPHENYL-4-CARBONITRILE
- 4'-Amino-3-Biphenylcarbonitrile
- SCHEMBL1029367
- 4-(3-Hydroxyphenyl)benzonitrile, 97%
- 3'-Hydroxy[1,1'-biphenyl]-4-carbonitrile
- 486455-27-0
- AKOS004116336
- MFCD05854257
- 3'-Hydroxy-[1,1'-biphenyl]-4-carbonitrile
- DTXSID30407245
-
- MDL： MFCD05854257
- Inchi： 1S/C13H9NO/c14-9-10-4-6-11(7-5-10)12-2-1-3-13(15)8-12/h1-8,15H
- InChI Key： LYCMNMIPSJWQRL-UHFFFAOYSA-N
- SMILES： OC1=CC=CC(=C1)C1C=CC(C#N)=CC=1
Computed Properties
- Exact Mass: 195.06800
- Monoisotopic Mass: 195.068413911g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 15
- Rotatable Bond Count: 1
- Complexity: 247
- 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: 2.9
- Topological Polar Surface Area: 44?2
Experimental Properties
- Melting Point: 160-164?°C (lit.)
- PSA: 44.02000
- LogP: 2.93088
4-(3-Hydroxyphenyl)benzonitrile Security Information
-
Symbol:
- Signal Word：Danger
- Hazard Statement： H302-H312-H318-H332
- Warning Statement： P280-P305+P351+P338
- Hazardous Material transportation number：UN 3077 9/PG 3
- WGK Germany：2
- Hazard Category Code： 20/21/22-41-51/53
- Safety Instruction： S26; S36/37/39; S61
-
Hazardous Material Identification：
- Risk Phrases：R20/21/22; R41; R51/53
4-(3-Hydroxyphenyl)benzonitrile Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| XI GE MA AO DE LI QI （ SHANG HAI ） MAO YI Co., Ltd. | 644005-1G |
4-(3-Hydroxyphenyl)benzonitrile |
486455-27-0 | 97% | 1G |
￥881.11 | 2022-02-24 | |
| abcr | AB175462-1 g |
3'-Hydroxybiphenyl-4-carbonitrile |
486455-27-0 | 1g |
€168.30 | 2022-06-11 | ||
| abcr | AB175462-5 g |
3'-Hydroxybiphenyl-4-carbonitrile |
486455-27-0 | 5g |
€542.50 | 2022-06-11 | ||
| abcr | AB175462-1g |
3'-Hydroxybiphenyl-4-carbonitrile; . |
486455-27-0 | 1g |
€191.40 | 2023-09-15 | ||
| abcr | AB175462-5g |
3'-Hydroxybiphenyl-4-carbonitrile; . |
486455-27-0 | 5g |
€872.00 | 2023-09-15 |
4-(3-Hydroxyphenyl)benzonitrile Related Literature
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Ivor Lon?ari? Phys. Chem. Chem. Phys., 2015,17, 9436-9445
-
Shintaro Takata,Yoshihiro Miura Phys. Chem. Chem. Phys., 2014,16, 24784-24789
-
Denis V. Korchagin,Elena A. Yureva,Alexander V. Akimov,Eugenii Ya. Misochko,Gennady V. Shilov,Artem D. Talantsev,Roman B. Morgunov,Alexander A. Shakin,Sergey M. Aldoshin,Boris S. Tsukerblat Dalton Trans., 2017,46, 7540-7548
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Eléonore Resongles,Corinne Casiot,Fran?oise Elbaz-Poulichet,Rémi Freydier,Odile Bruneel,Christine Piot,Sophie Delpoux,Aurélie Volant,Angélique Desoeuvre Environ. Sci.: Processes Impacts, 2013,15, 1536-1544
-
Jason Wan Lab Chip, 2020,20, 4528-4538
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