Ethyl 2-Cyano-3-(4-nitrophenyl)acrylate - CAS 2286-33-1
Catalog: |
BB017775 |
Product Name: |
Ethyl 2-Cyano-3-(4-nitrophenyl)acrylate |
CAS: |
2286-33-1 |
Synonyms: |
(E)-2-cyano-3-(4-nitrophenyl)-2-propenoic acid ethyl ester; ethyl (E)-2-cyano-3-(4-nitrophenyl)prop-2-enoate |
IUPAC Name: | ethyl (E)-2-cyano-3-(4-nitrophenyl)prop-2-enoate |
Description: | Ethyl 2-Cyano-3-(4-nitrophenyl)acrylate (CAS# 2286-33-1) is a useful research chemical. |
Molecular Weight: | 246.22 |
Molecular Formula: | C12H10N2O4 |
Canonical SMILES: | CCOC(=O)C(=CC1=CC=C(C=C1)[N+](=O)[O-])C#N |
InChI: | InChI=1S/C12H10N2O4/c1-2-18-12(15)10(8-13)7-9-3-5-11(6-4-9)14(16)17/h3-7H,2H2,1H3/b10-7+ |
InChI Key: | YVACJZRCOWZWPY-JXMROGBWSA-N |
Boiling Point: | 385.8 ℃ at 760 mmHg |
Density: | 1.306 g/cm3 |
LogP: | 2.58808 |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P264, P270, P301+P312, P330, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
EP-3553097-A1 | Copolymer and optical film using same | 20161207 |
US-2020095358-A1 | Copolymer and optical film using same | 20161207 |
CN-103351270-A | Method for catalyzing Knoevenagel condensation reaction by using function ion liquid | 20130515 |
CN-103351270-B | Method for catalyzing Knoevenagel condensation reaction by using function ion liquid | 20130515 |
US-2008058326-A1 | Substituted pyrazolopyridines and salts thereof, pharmaceutical compositions comprising same, methods of preparing same and uses of same | 20060613 |
Complexity: | 394 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 1 |
Exact Mass: | 246.06405680 |
Formal Charge: | 0 |
Heavy Atom Count: | 18 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 246.06405680 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 95.9 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.3 |
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