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2-Hydroxy-4-Dodecyloxybenzophenone
CAS: 2985-59-3 | C25H34O3
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
2985-59-3
Molecular Formula:
C25H34O3
Molecular Mass:
382.54 g/mol
Names and Synonyms:
2-Hydroxy-4-Dodecyloxybenzophenone
Methanone, [4-(dodecyloxy)-2-hydroxyphenyl]phenyl-
Benzophenone, 4-(dodecyloxy)-2-hydroxy-
[4-(Dodecyloxy)-2-hydroxyphenyl]phenylmethanone
4-Dodecyloxy-2-hydroxybenzophenone
2-Hydroxy-4-dodecyloxybenzophenone
DOBP
p-Dodecyloxy-2-hydroxybenzophenone
2-Hydroxy-4-n-dodecyloxybenzophenone
Eastman Inhibitor DOBP
Syntase 1200
Seesorb 103
2-Hydroxy-4-lauryloxybenzophenone
Chimassorb 125
UV-Chek AM 320
UV 1200
AM 320
2-Hydroxy-lauryloxy benzophenone
(4-Dodecoxy-2-hydroxyphenyl)-phenylmethanone
2-Benzoyl-5-(dodecyloxy)phenol
UV 538
Identifiers:
SMILES:
CCCCCCCCCCCCOc1ccc(C(=O)c2ccccc2)c(O)c1
InChI:
InChI=1S/C25H34O3/c1-2-3-4-5-6-7-8-9-10-14-19-28-22-17-18-23(24(26)20-22)25(27)21-15-12-11-13-16-21/h11-13,15-18,20,26H,2-10,14,19H2,1H3
Key Properties
Melting Point
49-50 °C
CAS Common Chemistry
Spectral Data
NMR, IR, and Mass spectral data
1H NMR
13C NMR
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 |
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Note: These NMR spectra are predicted computationally and may differ from experimental data. Predictions are based on chemical environment analysis.
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 382.54 g/mol | CAS Common Chemistry |
| 382.54400000000004 g/mol | RDKit | |
| 382.25079494799996 g/mol | RDKit | |
| Canonical SMILES | O=C(C=1C=CC=CC1)C2=CC=C(OCCCCCCCCCCCC)C=C2O | CAS Common Chemistry |
| InChI | InChI=1S/C25H34O3/c1-2-3-4-5-6-7-8-9-10-14-19-28-22-17-18-23(24(26)20-22)25(27)21-15-12-11-13-16-21/h11-13,15-18,20,26H,2-10,14,19H2,1H3 | CAS Common Chemistry |
| InChI Key | InChIKey=ARVUDIQYNJVQIW-UHFFFAOYSA-N | CAS Common Chemistry |
| Melting Point | 49-50 °C | CAS Common Chemistry |
| Name | 2-Hydroxy-4-dodecyloxybenzophenone | CAS Common Chemistry |
| Heavy Atom Count | 28 | RDKit |
| Hydrogen Bond Acceptors | 3 | RDKit |
| Hydrogen Bond Donors | 1 | RDKit |
| Rotatable Bonds | 14 | RDKit |
| Aromatic Ring Count | 2 | RDKit |
| Topological Polar Surface Area | 46.53 Ų | RDKit |
| LogP | 6.922900000000008 | RDKit |
| Molar Refractivity | 115.32030000000005 | RDKit |
