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Molecule
Benzyl 2-propenoate
CAS: 2495-35-4 · C10H10O2
2D Structure
3D Structure
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Basic Information
- CAS Registry Number
- 2495-35-4
- Molecular Formula
- C10H10O2
- Molecular Mass
- 162.19 g/mol
Identifiers
CAS Registry Number
2495-35-4
SMILES
C=CC(=O)OCc1ccccc1
InChI Key
GCTPMLUUWLLESL-UHFFFAOYSA-N
InChI
InChI=1S/C10H10O2/c1-2-10(11)12-8-9-6-4-3-5-7-9/h2-7H,1,8H2
Names and Synonyms
- Benzyl 2-propenoate Synonym
- NSC 20964 Synonym
- Viscoat 160 Synonym
- V 160 Synonym
- FA-BZA Synonym
- Fancryl FA-BZA Synonym
- V 180 Synonym
- A-BZ Synonym
- M 1182 Synonym
- Miramer M 1182 Synonym
- Benzyl Acrylate Synonym
- 2-Propenoic acid, phenylmethyl ester Synonym
- Acrylic acid, benzyl ester Synonym
- Benzyl acrylate Synonym
- Sartomer SR 432 Synonym
- SR 432 Synonym
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 162.19 g/mol | CAS Common Chemistry |
| 162.188 g/mol | RDKit | |
| Density | 1.05 g/cm³ | CAS Common Chemistry |
| 1.053 g/cm3 @ 20 °C | CAS Common Chemistry | |
| Canonical SMILES | O=C(OCC=1C=CC=CC1)C=C | CAS Common Chemistry |
| InChI | InChI=1S/C10H10O2/c1-2-10(11)12-8-9-6-4-3-5-7-9/h2-7H,1,8H2 | CAS Common Chemistry |
| InChI Key | InChIKey=GCTPMLUUWLLESL-UHFFFAOYSA-N | CAS Common Chemistry |
| Melting Point | 214-216 °C | CAS Common Chemistry |
| Name | Benzyl acrylate | CAS Common Chemistry |
| Heavy Atom Count | 12 | RDKit |
| Hydrogen Bond Acceptors | 2 | RDKit |
| Hydrogen Bond Donors | 0 | RDKit |
| Rotatable Bonds | 3 | RDKit |
| Aromatic Ring Count | 1 | RDKit |
| Topological Polar Surface Area | 26.3 Ų | RDKit |
| LogP | 1.9158 | RDKit |
| Molar Refractivity | 46.435000000000024 cm³/mol | RDKit |
| Ring Count | 1 | RDKit |
| Formal Charge | 0 | RDKit |
| Fraction Csp3 | 0.1 | RDKit |
| Exact Mass | 162.06807956 g/mol | RDKit |
| Boiling Point | 94 °C @ 6 Torr | CAS Common Chemistry |
Spectral Data
NMR, IR, and Mass spectral data
Predicting NMR spectra...
10 ppm
9
8
7
6
5
4
3
2
1
0 ppm
| Shift (ppm) | Multiplicity | Integration | Assignment |
|---|
200 ppm
180
160
140
120
100
80
60
40
20
0 ppm
| Shift (ppm) | DEPT | Assignment |
|---|
Note: These NMR spectra are predicted computationally and may differ from experimental data. Predictions are based on chemical environment analysis.
External Resources
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MW = 162.19 g/mol; density = 1.050 g/mL. Edit any field — others recompute live.
Related
Related molecules
Other compounds with formula C10H10O2.
