Cas no 81038-44-0 (3-Bromo-4-hydroxy-5-methoxyphenylacetonitrile)
81038-44-0 structure
Product Name:3-Bromo-4-hydroxy-5-methoxyphenylacetonitrile
CAS No:81038-44-0
MF:C9H8BrNO2
MW:242.069321632385
MDL:MFCD00060307
CID:720278
PubChem ID:522744
Update Time:2025-04-19
3-Bromo-4-hydroxy-5-methoxyphenylacetonitrile Chemical and Physical Properties
Names and Identifiers
-
- Benzeneacetonitrile, 3-bromo-4-hydroxy-5-methoxy-
- 2-(3-bromo-4-hydroxy-5-methoxyphenyl)acetonitrile
- 3-Bromo-4-hydroxy-5-methoxyphenylacetonitrile
- 3-Methoxy-4-hydroxy-5-brom-phenyl-acetonitril
- VMARCRAWRNPBBQ-UHFFFAOYSA-N
- MFCD00060307
- EN300-1910632
- FT-0641805
- CS-0302558
- DTXSID10335052
- 2-(3-bromo-4-hydroxy-5-methoxy-phenyl)acetonitrile
- SCHEMBL6897446
- A840025
- 81038-44-0
- AKOS015834617
- DB-022342
-
- MDL： MFCD00060307
- Inchi： 1S/C9H8BrNO2/c1-13-8-5-6(2-3-11)4-7(10)9(8)12/h4-5,12H,2H2,1H3
- InChI Key： VMARCRAWRNPBBQ-UHFFFAOYSA-N
- SMILES： BrC1C(=C(C=C(CC#N)C=1)OC)O
Computed Properties
- Exact Mass: 240.97400
- Monoisotopic Mass: 240.97384g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 13
- Rotatable Bond Count: 2
- Complexity: 213
- 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: 1.9
- Topological Polar Surface Area: 53.2?2
Experimental Properties
- Melting Point: 145-147°C
- PSA: 53.25000
- LogP: 2.22938
3-Bromo-4-hydroxy-5-methoxyphenylacetonitrile Security Information
- Hazard Statement： Toxic
- Hazardous Material transportation number：UN 3439
- Hazard Category Code： 20/21/22-36/37/38
- Safety Instruction： S26; S36/37/39
-
Hazardous Material Identification：
- HazardClass：IRRITANT
- Risk Phrases：R20/21/22; R36/37/38
3-Bromo-4-hydroxy-5-methoxyphenylacetonitrile 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-Bromo-4-hydroxy-5-methoxyphenylacetonitrile Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| Fluorochem | 018281-1g |
3-Bromo-4-hydroxy-5-methoxyphenylacetonitrile |
81038-44-0 | 1g |
￡74.00 | 2022-03-01 | ||
| Fluorochem | 018281-5g |
3-Bromo-4-hydroxy-5-methoxyphenylacetonitrile |
81038-44-0 | 5g |
￡197.00 | 2022-03-01 | ||
| TRC | B997153-100mg |
3-Bromo-4-hydroxy-5-methoxyphenylacetonitrile |
81038-44-0 | 100mg |
$ 70.00 | 2022-06-06 | ||
| TRC | B997153-500mg |
3-Bromo-4-hydroxy-5-methoxyphenylacetonitrile |
81038-44-0 | 500mg |
$ 230.00 | 2022-06-06 | ||
| TRC | B997153-1g |
3-Bromo-4-hydroxy-5-methoxyphenylacetonitrile |
81038-44-0 | 1g |
$ 340.00 | 2022-06-06 | ||
| abcr | AB149443-1 g |
3-Bromo-4-hydroxy-5-methoxyphenylacetonitrile, 97%; . |
81038-44-0 | 97% | 1 g |
€165.50 | 2023-07-20 | |
| abcr | AB149443-5 g |
3-Bromo-4-hydroxy-5-methoxyphenylacetonitrile, 97%; . |
81038-44-0 | 97% | 5 g |
€352.50 | 2023-07-20 | |
| abcr | AB149443-1g |
3-Bromo-4-hydroxy-5-methoxyphenylacetonitrile, 97%; . |
81038-44-0 | 97% | 1g |
€165.50 | 2025-04-16 | |
| abcr | AB149443-5g |
3-Bromo-4-hydroxy-5-methoxyphenylacetonitrile, 97%; . |
81038-44-0 | 97% | 5g |
€352.50 | 2025-04-16 | |
| Enamine | EN300-1910632-1g |
2-(3-bromo-4-hydroxy-5-methoxyphenyl)acetonitrile |
81038-44-0 | 1g |
$857.0 | 2023-09-17 |
3-Bromo-4-hydroxy-5-methoxyphenylacetonitrile Related Literature
-
Gang Pan,Yi-jie Bao,Jie Xu,Tao Liu,Cheng Liu,Yan-yan Qiu,Xiao-jing Shi,Hui Yu,Ting-ting Jia,Xia Yuan,Ze-ting Yuan,Yi-jun Cao RSC Adv., 2016,6, 42109-42119
-
Shaun D. Wong,Edward I. Solomon Dalton Trans., 2014,43, 17567-17577
-
Chung-Sung Yang,Mong-Shian Shih,Fang-Yi Chang New J. Chem., 2006,30, 729-735
-
Norihito Fukui,Keisuke Fujimoto,Hideki Yorimitsu,Atsuhiro Osuka Dalton Trans., 2017,46, 13322-13341
81038-44-0 (3-Bromo-4-hydroxy-5-methoxyphenylacetonitrile) Related Products
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