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Dimyristyl Thiodipropionate
CAS: 16545-54-3 | C34H66O4S
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
16545-54-3
Molecular Formula:
C34H66O4S
Molecular Mass:
570.97 g/mol
Names and Synonyms:
Dimyristyl Thiodipropionate
Propanoic acid, 3,3′-thiobis-, 1,1′-ditetradecyl ester
Propionic acid, 3,3′-thiodi-, ditetradecyl ester
Propanoic acid, 3,3′-thiobis-, ditetradecyl ester
Advastab PS 801
Myristyl thiodipropionate
Dimyristyl 3,3′-thiodipropionate
Advastab 801
Dimyristyl thiodipropionate
Advastab 810
AO 4
DMTP
TPM
Sumilizer TPM
Seenox DM
Ditetradecylthiodipropionate
Chimox 14
Cyanox MTDP
Yoshinox DMTP
Tetradecyl 3,3′-thiodipropionate
DMTP Yoshitomi
Antioxidant TPM
DMTDP
Antioxidant DM
Identifiers:
SMILES:
CCCCCCCCCCCCCCOC(=O)CCSCCC(=O)OCCCCCCCCCCCCCC
InChI:
InChI=1S/C34H66O4S/c1-3-5-7-9-11-13-15-17-19-21-23-25-29-37-33(35)27-31-39-32-28-34(36)38-30-26-24-22-20-18-16-14-12-10-8-6-4-2/h3-32H2,1-2H3
Key Properties
Melting Point
48-50 °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 |
|---|
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 | 570.97 g/mol | CAS Common Chemistry |
| 570.9650000000003 g/mol | RDKit | |
| 570.468181592 g/mol | RDKit | |
| Canonical SMILES | O=C(OCCCCCCCCCCCCCC)CCSCCC(=O)OCCCCCCCCCCCCCC | CAS Common Chemistry |
| InChI | InChI=1S/C34H66O4S/c1-3-5-7-9-11-13-15-17-19-21-23-25-29-37-33(35)27-31-39-32-28-34(36)38-30-26-24-22-20-18-16-14-12-10-8-6-4-2/h3-32H2,1-2H3 | CAS Common Chemistry |
| InChI Key | InChIKey=LVEOKSIILWWVEO-UHFFFAOYSA-N | CAS Common Chemistry |
| Melting Point | 48-50 °C | CAS Common Chemistry |
| Name | Dimyristyl thiodipropionate | CAS Common Chemistry |
| Heavy Atom Count | 39 | RDKit |
| Hydrogen Bond Acceptors | 5 | RDKit |
| Hydrogen Bond Donors | 0 | RDKit |
| Rotatable Bonds | 32 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 52.60000000000001 Ų | RDKit |
| LogP | 10.988399999999992 | RDKit |
| Molar Refractivity | 170.63299999999956 | RDKit |
