Basic information
- CAS
31330-51-5- Standard SMILES
CCOC(=O)C(C#N)=Cc1cccs1- InChIKey
RULXBTAXOUSEDI-UHFFFAOYSA-N- Molecular formula
- C10H9NO2S
- Average molar mass
- 207.25 g/mol
- Monoisotopic mass
- 207.0353997
Names & identifiers
- Preferred name
- Ethyl 2-cyano-3-(2-thienyl)acrylate
- IUPAC
- ethyl 2-cyano-3-thiophen-2-ylprop-2-enoate
- English name
- Ethyl 2-cyano-3-(2-thienyl)acrylate
- Molecular formula
- C10H9NO2S
- Molecular weight
- 207.25
Names & synonyms
ethyl 2-cyano-3-(2-thienyl)acrylateSCHEMBL10672849DTXSID301274627AKOS017083046DB-048013Ethyl 2-cyano-3-(2-thienyl)-2-propenoateethyl 2-cyano-3-(thiophen-2-yl)prop-2-enoate2-cyano-3-thiophen-2-yl-acrylic acid ethyl esterRARECHEM AK ML 0028Ethyl 2-cyano-3-thien-2-ylacrylateEthyl 2-cyano-3-(thiophen-2-yl)acrylateEthyl(E)-2-cyano-3-(thien-2-yl)acrylate
Show more names
Ethyl (E)-2-cyano-3-(thiophen-2-yl)acrylateα-Cyanothiophene-2-acrylic acid ethyl esterα-Cyano-2-thiopheneacrylic acid ethyl esteralpha-cyano-2-thiopheneacrylicaciethylester2-Cyano-3-(2-thienyl)acrylic acid ethyl ester
Database identifiers
- CAS
31330-51-5- PubChem CID
- 97874
- DTXSID
DTXSID301274627
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 78.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 290
Physicochemical properties
- Melting point
- 79 · 79-82°C
- Boiling point
- 340.8 · 340.8±32.0 °C(Predicted)
- Density
- 1.247 · 1.247±0.06 g/cm3(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302+H312+H332-H315-H319-H335
- Precautionary statements
- 260 · P260-P280-P312
- Hazard Codes
- Xi
- HazardClass
- IRRITANT
- HS Code
- 2934999090 · 2934999090
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- hs_code
- 2934999090
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xi
- hazard_class
- IRRITANT
- Hazard statements
- H302+H312+H332-H315-H319-H335
- Precautionary statements
- P260-P280-P312
Chemistry & industry
Suppliers8 total
上海迈瑞尔生化科技有限公司4006356688 18621169109 · [email protected]
武汉凯威斯科技有限公司86-027-67849912 · [email protected]
北京福源坊科技有限公司010-57903446 15869909019 · [email protected]
成都卡麦尔医药科技有限公司028-67136579 15828051124 · [email protected]
天津康利欣科技有限公司18622939839 · [email protected]
上海麦克林生化科技股份有限公司50706066 15221275939 · [email protected]
深圳聚合生化科技有限公司+86-400-002-6226 13028896684 · [email protected]
北京百灵威科技有限公司18210857532 18210857532 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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