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Molybdenum Disulfide
CAS: 1317-33-5 | MoS2
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
1317-33-5
Molecular Formula:
MoS2
Molecular Weight:
160.074 g/mol
Names and Synonyms:
Molybdenum Disulfide
LM 12
XT 0805-3-1
HD 7352
ZBY 801
Liqui-Moly LM 12
XF 209
XF 184-1
XT 0808-2-2
L-GPM 210
ZWEZ-Lube MD 210
McLube MoS2 99
McLube MoS2 100
McLube MoS2 98
ZBM 52-999
M 5 Powder
RAC 01
MF 000
MIPO-M 15
Liqui-Moly Z Powder
Molykote Z Powder
OKS 110
DMI 7
C-Powder
Defric coat HMB 2
MVCh 1
Molyform 15
UP 50
UP 10
Molybdenum sulphide (MoS2)
Molyka R-L 3
NeoZ
Moly Fine Powder Y
A Powder
Powder PA
PA Powder
M 5 (lubricant)
M 5
Molyka R
Molykote Microsize Powder
Molycolloid CF 626
T-Powder
Nichimoly C
Solvest 390A
DM 1 (sulfide)
LM 13 (lubricant)
LM 13
Molykote Z
Sumipowder PA
Pigment Black 34
C.I. 77770
C.I. Pigment Black 34
Moly Powder PB
Molybdenum bisulfide
Moly Powder PS
Liqui-Moly LM 11
Moly Powder B
Moly Powder PA
Molybdenum sulfide
Moly Powder C
MD 40
MD 40 (lubricant)
DM 1
Liqui-Moly LM 2
Molysulfide
DAG 206
Motimol
DAG-V 657
Mopol M
Mopol S
Molykote
DAG 325
Molybdenum disulfide (MoS2)
Molybdenum(IV) sulfide
Molybdenum disulfide
Molybdenum sulfide (MoS2)
Identifiers:
SMILES:
[Mo].[S].[S]
InChI:
InChI=1S/Mo.2S
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
Physical Properties
| Property | Value | Source |
|---|---|---|
| molecular_mass | 160.07 g/mol | Legacy Database |
| density | 5.06 g/cm³ | Legacy Database |
| wikipedia_url | https://en.wikipedia.org/wiki/Molybdenum_disulfide None | Legacy Database |
| cas-canonical-smile | S=[Mo]=S None | Legacy Database |
| cas-density | 5.06 g/cm3 @ Temp: 15 °C None | Legacy Database |
| cas-inchi | InChI=1S/Mo.2S None | Legacy Database |
| cas-inchi-key | InChIKey=CWQXQMHSOZUFJS-UHFFFAOYSA-N None | Legacy Database |
| cas-melting-point | 2375 °C None | Legacy Database |
| cas-name | Molybdenum disulfide None | Legacy Database |
| wikipedia-name | Molybdenum disulfide None | Legacy Database |
| LogP | 1.2939 | RDKit |
Molecular
| Property | Value | Source |
|---|---|---|
| Molecular Weight | 160.074 g/mol | RDKit |
Exact
| Property | Value | Source |
|---|---|---|
| Exact Molecular Weight | 161.84955019999998 g/mol | RDKit |
Heavy
| Property | Value | Source |
|---|---|---|
| Heavy Atom Count | 3 count | RDKit |
Hydrogen
| Property | Value | Source |
|---|---|---|
| Hydrogen Bond Acceptors | 0 count | RDKit |
| Hydrogen Bond Donors | 0 count | RDKit |
Rotatable
| Property | Value | Source |
|---|---|---|
| Rotatable Bonds | 0 count | RDKit |
Aromatic
| Property | Value | Source |
|---|---|---|
| Aromatic Ring Count | 0 count | RDKit |
Topological
| Property | Value | Source |
|---|---|---|
| Topological Polar Surface Area | 0.0 Ų | RDKit |
Molar
| Property | Value | Source |
|---|---|---|
| Molar Refractivity | 15.182 | RDKit |
