Decyl 2-cyanoacrylate
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Basic information
- CAS
3578-07-2- Standard SMILES
C=C(C#N)C(=O)OCCCCCCCCCC- InChIKey
KWKVJEUILVQMRR-UHFFFAOYSA-N- Molecular formula
- C14H23NO2
- Average molar mass
- 237.34 g/mol
- Monoisotopic mass
- 237.17287898
Names & identifiers
- Preferred name
- Decyl 2-cyanoacrylate
- IUPAC
- decyl 2-cyanoprop-2-enoate
- English name
- decyl 2-cyanoacrylate
- Molecular formula
- C14H23NO2
- Molecular weight
- 237.34
Names & synonyms
Decyl 2-cyanoacrylatedecyl 2-cyanoprop-2-enoate3578-07-2S88DFQ3VZN2-Propenoic acid, 2-cyano-, decyl esterdecyl-2-cyanoacrylateUNII-S88DFQ3VZNDecyl 2-cyano-2-propenoateSCHEMBL973728DTXSID40189308KWKVJEUILVQMRR-UHFFFAOYSA-NEINECS 222-699-3
Show more names
n-decyl 2-cyanoacrylateα-Cyanoacrylic acid decyl ester2-Cyanopropenoic acid decyl ester
NS00046914
Database identifiers
- CAS
3578-07-2- PubChem CID
- 77127
- DTXSID
DTXSID40189308- UNII
- S88DFQ3VZN
- EC Number
- 222-699-3
- Nikkaji
- J216.213J
Properties
Computed structural propertiesFilling in
- XLogP
- 5.1
- Topological polar surface area
- 50.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 11
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 275
Physicochemical properties
- Boiling point
- 335.7 · 335.7±25.0 °C(Predicted)
- Density
- 0.944 · 0.944±0.06 g/cm3(Predicted)
- FDA UNII
- 88 DFQ3VZN · S88DFQ3VZN
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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