Cyanoethyl methacrylate
Basic information
- CAS
4513-53-5- Standard SMILES
C=C(C)C(=O)OCCC#N- InChIKey
VKNASXZDGZNEDA-UHFFFAOYSA-N- Molecular formula
- C7H9NO2
- Average molar mass
- 139.15 g/mol
- Monoisotopic mass
- 139.06332853
Names & identifiers
- Preferred name
- Cyanoethyl methacrylate
- IUPAC
- 2-cyanoethyl 2-methylprop-2-enoate
- English name
- β-Cyanoethyl methacrylate
- Molecular formula
- C7H9NO2
- Molecular weight
- 139.15
Names & synonyms
2-Cyanoethyl methacrylate4513-53-5Cyanoethyl methacrylateMETHACRYLIC ACID, ESTER with HYDRACRYONITRILEV4D27A7L5S2-Propenoic acid, 2-methyl-, 2-cyanoethyl esterNSC-32622DTXSID20196398RefChem:1082382DTXCID30118889224-835-72-cyanoethyl 2-methylprop-2-enoate
Show more names
β-Cyanoethyl methacrylate2-cyanoethyl2-methyl-2-propenoateMethacrylic acid hydracrylonitrileMethacrylic acid 2-cyanoethyl ester2-methylacrylic acid 2-cyanoethyl ester2-methyl-2-propenoicaci2-cyanoethylester
Beta-cyanoethyl methacrylate2-Cyanoethyl 2-methyl-2-propenoateEINECS 224-835-7NSC 32622BRN 2349676UNII-V4D27A7L5SSCHEMBL33780NSC32622
Database identifiers
- CAS
4513-53-5- PubChem CID
- 20610
- DTXSID
DTXSID20196398- UNII
- V4D27A7L5S
- EC Number
- 224-835-7
- Nikkaji
- J78.375G
Properties
Computed structural properties
- XLogP
- 1.3
- Topological polar surface area
- 50.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 187
Physicochemical properties
- Boiling point
- 99 · 99-100°C 2mm
- Density
- 1.0498 g/ml · 1.0498g/ml
- refractive index
- 1.4454 · 1.4454 (589.3 nm 20℃)
- FDA UNII
- 4 D27A7L5S · V4D27A7L5S
- Risk Statements
- 20 · 20/21/22-36/37/38
- Safety Statements
- 26 · 26-36/37/39
- RIDADR
- 3276 · 3276
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
- ridadr
- 3276
- risk_code
- 20/21/22-36/37/38
- safety_code
- 26-36/37/39
Related reactions
1 records
Compound notes
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