Cas no 86213-20-9 (2-Propenoic acid,2-cyano-3-(3,4-dimethoxyphenyl)-)
86213-20-9 structure
Product Name:2-Propenoic acid,2-cyano-3-(3,4-dimethoxyphenyl)-
CAS No:86213-20-9
MF:C12H11NO4
MW:233.220043420792
CID:720202
PubChem ID:616261
Update Time:2025-04-19
2-Propenoic acid,2-cyano-3-(3,4-dimethoxyphenyl)- Chemical and Physical Properties
Names and Identifiers
-
- 2-Propenoic acid,2-cyano-3-(3,4-dimethoxyphenyl)-
- 2-cyano-3-(3,4-dimethoxyphenyl)-2-Propenoic acid
- 2-cyano-3-(3,4-dimethoxyphenyl)prop-2-enoic acid
- ALPHA-CYANO-3,4-DIMETHOXYCINNAMIC ACID
- 3,4-dimethoxybenzalcyanoacetic acid
- 3.4-Dimethoxy-benzylidencyanessigsaeure
- FT-0653532
- DTXSID70346902
- alpha-Cyano-3,4-dimethoxycinnamicacid
- A841580
- DMACYVMZKYRYSL-UHFFFAOYSA-N
- 86213-20-9
-
- Inchi： 1S/C12H11NO4/c1-16-10-4-3-8(6-11(10)17-2)5-9(7-13)12(14)15/h3-6H,1-2H3,(H,14,15)
- InChI Key： DMACYVMZKYRYSL-UHFFFAOYSA-N
- SMILES： O(C)C1C=C(C=C(C#N)C(=O)O)C=CC=1OC
Computed Properties
- Exact Mass: 233.06900
- Monoisotopic Mass: 233.069
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 17
- Rotatable Bond Count: 4
- Complexity: 355
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 1
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 79.6A^2
- XLogP3: 1.7
Experimental Properties
- Melting Point: 204-208°C
- PSA: 79.55000
- LogP: 1.69538
2-Propenoic acid,2-cyano-3-(3,4-dimethoxyphenyl)- 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%
2-Propenoic acid,2-cyano-3-(3,4-dimethoxyphenyl)- Related Literature
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Chengbin Yang,Hing Lun Tsang,Pui Man Lau,Ken-Tye Yong,Ho Pui Ho,Siu Kai Kong Analyst, 2017,142, 3579-3587
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2. An all-solid-state imprinted polymer-based potentiometric sensor for determination of bisphenol S?Rongning Liang,Tanji Yin,Ruiqing Yao,Wei Qin RSC Adv., 2016,6, 73308-73312
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Robert J. Meagher,Anson V. Hatch,Ronald F. Renzi,Anup K. Singh Lab Chip, 2008,8, 2046-2053
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Teresita Carrillo-Hernández,Philippe Schaeffer,Pierre Albrecht Chem. Commun., 2001, 1976-1977
Related Categories
- Solvents and Organic Chemicals Organic Compounds Phenylpropanoids and polyketides Cinnamic acids and derivatives Coumaric acids and derivatives
- Solvents and Organic Chemicals Organic Compounds Phenylpropanoids and polyketides Cinnamic acids and derivatives Hydroxycinnamic acids and derivatives Coumaric acids and derivatives
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