Cas no 929000-02-2 (3-Hydroxy-5-nitrobenzonitrile)
3-Hydroxy-5-nitrobenzonitrile is a nitrated aromatic compound featuring both hydroxyl and nitrile functional groups, making it a versatile intermediate in organic synthesis. Its molecular structure (C7H4N2O3) enables applications in pharmaceuticals, agrochemicals, and specialty chemicals, particularly as a precursor for heterocyclic compounds. The presence of electron-withdrawing nitro and cyano groups enhances reactivity in nucleophilic substitution and condensation reactions. This compound is valued for its high purity and stability under controlled conditions, ensuring consistent performance in synthetic processes. Its solubility in polar organic solvents further facilitates its use in laboratory and industrial settings. Proper handling is advised due to potential sensitivity to heat and strong oxidizers.
3-Hydroxy-5-nitrobenzonitrile structure
Product Name:3-Hydroxy-5-nitrobenzonitrile
CAS No:929000-02-2
MF:C7H4N2O3
MW:164.11826133728
MDL:MFCD09258662
CID:857937
PubChem ID:26967604
Update Time:2025-06-07
3-Hydroxy-5-nitrobenzonitrile Chemical and Physical Properties
Names and Identifiers
-
- 3-Hydroxy-5-nitrobenzonitrile
- OR8249
- 3-Hydroxy-5-nitrobenzonitrile (ACI)
- PS-10590
- 929000-02-2
- AKOS006345741
- SCHEMBL15517110
- D82423
- CS-0157693
- DB-105586
- SY365141
- MFCD09258662
- QGVJKELIWFBDSC-UHFFFAOYSA-N
- DTXSID40650381
-
- MDL： MFCD09258662
- Inchi： 1S/C7H4N2O3/c8-4-5-1-6(9(11)12)3-7(10)2-5/h1-3,10H
- InChI Key： QGVJKELIWFBDSC-UHFFFAOYSA-N
- SMILES： N#CC1C=C([N+](=O)[O-])C=C(O)C=1
Computed Properties
- Exact Mass: 164.02200
- Monoisotopic Mass: 164.02219199g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 12
- Rotatable Bond Count: 1
- Complexity: 227
- 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: 2.2
- Topological Polar Surface Area: 89.8?2
Experimental Properties
- PSA: 89.84000
- LogP: 1.69528
3-Hydroxy-5-nitrobenzonitrile 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%
3-Hydroxy-5-nitrobenzonitrile Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| SHANG HAI A LA DING SHENG HUA KE JI GU FEN Co., Ltd. | H188331-5g |
3-Hydroxy-5-nitrobenzonitrile |
929000-02-2 | 98% | 5g |
￥5486.90 | 2023-09-02 | |
| Fluorochem | 209358-250mg |
3-Hydroxy-5-nitrobenzonitrile |
929000-02-2 | 95% | 250mg |
￡82.00 | 2022-03-01 | |
| Fluorochem | 209358-5g |
3-Hydroxy-5-nitrobenzonitrile |
929000-02-2 | 95% | 5g |
￡887.00 | 2022-03-01 | |
| Alichem | A014003291-1g |
3-Hydroxy-5-nitrobenzonitrile |
929000-02-2 | 97% | 1g |
$1460.20 | 2023-08-31 | |
| SHANG HAI XIAN DING Biotechnology Co., Ltd. | B-VX329-200mg |
3-Hydroxy-5-nitrobenzonitrile |
929000-02-2 | 98% | 200mg |
439.0CNY | 2021-08-04 | |
| SHANG HAI XIAN DING Biotechnology Co., Ltd. | B-VX329-1g |
3-Hydroxy-5-nitrobenzonitrile |
929000-02-2 | 98% | 1g |
1995.0CNY | 2021-08-04 | |
| TRC | H950823-25mg |
3-Hydroxy-5-nitrobenzonitrile |
929000-02-2 | 25mg |
$64.00 | 2023-05-18 | ||
| TRC | H950823-50mg |
3-Hydroxy-5-nitrobenzonitrile |
929000-02-2 | 50mg |
$69.00 | 2023-05-18 | ||
| TRC | H950823-100mg |
3-Hydroxy-5-nitrobenzonitrile |
929000-02-2 | 100mg |
$92.00 | 2023-05-18 | ||
| TRC | H950823-250mg |
3-Hydroxy-5-nitrobenzonitrile |
929000-02-2 | 250mg |
$161.00 | 2023-05-18 |
3-Hydroxy-5-nitrobenzonitrile Related Literature
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Marcin Czapla,Jack Simons Phys. Chem. Chem. Phys., 2018,20, 21739-21745
-
Christopher B. Rodell,Christopher B. Highley,Minna H. Chen,Neville N. Dusaj,Chao Wang,Lin Han,Jason A. Burdick Soft Matter, 2016,12, 7839-7847
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Eric Besson,Stéphane Gastaldi,Emily Bloch,Selma Aslan,Hakim Karoui,Olivier Ouari,Micael Hardy Analyst, 2019,144, 4194-4203
-
Min Kim,Jae-Joon Lee,Tengling Ye,Panagiotis E. Keivanidis,Kilwon Cho J. Mater. Chem. C, 2020,8, 1686-1696
-
Yu Long,Bing Yuan,Jianrui Niu,Xin Tong,Jiantai Ma New J. Chem., 2015,39, 1179-1185
929000-02-2 (3-Hydroxy-5-nitrobenzonitrile) Related Products
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- 116313-86-1(Benzonitrile,3,4-dihydroxy-5-nitro-)
- 127818-58-0(3-Methyl-5-nitrophenol)
- 619-24-9(3-Nitrobenzonitrile)
- 116314-86-4(Benzonitrile,2,3-dihydroxy-5-nitro-)
- 17076-68-5(4-(4-Nitrophenoxy)benzonitrile)
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- 13589-74-7(5-Hydroxy-2-nitrobenzonitrile)
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