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Distearyl Thiodipropionate
CAS: 693-36-7 | C42H82O4S
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
693-36-7
Molecular Formula:
C42H82O4S
Molecular Mass:
683.18 g/mol
Names and Synonyms:
Distearyl Thiodipropionate
NSC 65493
Distearyl-3,3-thiodipropionate
Negonox DSTP
Carstab DSTDP
Yoshinox DSTP
Lowinox DSTDP
PS 802FL
Irganox 802FD
Antioxidant 802
Cyanox OTDP
DSTP Yoshitomi
Irganox PS 802FD
Songnox DSTDP
Lasumit SG
Antioxidant DSTP
AO 180T
Arenox DS
Antioxidant DSTDP
Rianox DSTP
Mark DSTDP
Jyanox DSTDP
Propanoic acid, 3,3′-thiobis-, 1,1′-dioctadecyl ester
Propionic acid, 3,3′-thiodi-, dioctadecyl ester
Propanoic acid, 3,3′-thiobis-, dioctadecyl ester
Distearyl thiodipropionate
Distearyl β,β′-thiodipropionate
Distearyl 3,3′-thiodipropionate
PS 802
Plastanox STDP Antioxidant
Advastab PS 802
Dioctadecyl thiodipropionate
Stearyl 3,3′-thiodipropionate
Plastanox STDP
Dioctadecyl 3,3′-thiodipropionate
Advastab 802
Distearyl β-thiodipropionate
Cyanox STDP
DSTDP
Hostanox VP-SE 2
Yoshinox DSTDP
Irganox PS 802
DSTP
Hostanox SE 2
Lusmit SS
Naugard DSTDP
Arbestab DSTDP
Sumilizer TPS
Seenox DS
Antiox S
Varox DSTDP
Thio 1
Evanstab 18
Hostanox SE 4
Irganox PS 802FL
Identifiers:
SMILES:
CCCCCCCCCCCCCCCCCCOC(=O)CCSCCC(=O)OCCCCCCCCCCCCCCCCCC
InChI:
InChI=1S/C42H82O4S/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-37-45-41(43)35-39-47-40-36-42(44)46-38-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h3-40H2,1-2H3
Key Properties
Melting Point
60 °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 | 683.18 g/mol | CAS Common Chemistry |
| 683.1809999999996 g/mol | RDKit | |
| 682.5933821039999 g/mol | RDKit | |
| Canonical SMILES | O=C(OCCCCCCCCCCCCCCCCCC)CCSCCC(=O)OCCCCCCCCCCCCCCCCCC | CAS Common Chemistry |
| InChI | InChI=1S/C42H82O4S/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-37-45-41(43)35-39-47-40-36-42(44)46-38-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h3-40H2,1-2H3 | CAS Common Chemistry |
| InChI Key | InChIKey=PWWSSIYVTQUJQQ-UHFFFAOYSA-N | CAS Common Chemistry |
| Melting Point | 60 °C | CAS Common Chemistry |
| Name | Distearyl thiodipropionate | CAS Common Chemistry |
| Heavy Atom Count | 47 | RDKit |
| Hydrogen Bond Acceptors | 5 | RDKit |
| Hydrogen Bond Donors | 0 | RDKit |
| Rotatable Bonds | 40 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 52.60000000000001 Ų | RDKit |
| LogP | 14.109199999999971 | RDKit |
| Molar Refractivity | 207.5689999999991 | RDKit |
