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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 Mass:
160.07 g/mol
Names and Synonyms:
Molybdenum Disulfide
Molybdenum sulfide (MoS2)
Molybdenum disulfide
Molybdenum(IV) sulfide
Molybdenum disulfide (MoS2)
DAG 325
Molykote
Mopol S
Mopol M
DAG-V 657
Motimol
DAG 206
Molysulfide
Liqui-Moly LM 2
DM 1
MD 40 (lubricant)
MD 40
Moly Powder C
Molybdenum sulfide
Moly Powder PA
Moly Powder B
Liqui-Moly LM 11
Moly Powder PS
Molybdenum bisulfide
Moly Powder PB
C.I. Pigment Black 34
C.I. 77770
Pigment Black 34
Sumipowder PA
Molykote Z
LM 13
LM 13 (lubricant)
DM 1 (sulfide)
Solvest 390A
Nichimoly C
T-Powder
Molycolloid CF 626
Molykote Microsize Powder
Molyka R
M 5
M 5 (lubricant)
PA Powder
Powder PA
A Powder
Moly Fine Powder Y
NeoZ
Molyka R-L 3
Molybdenum sulphide (MoS2)
UP 10
UP 50
Molyform 15
MVCh 1
Defric coat HMB 2
C-Powder
DMI 7
OKS 110
Molykote Z Powder
Liqui-Moly Z Powder
MIPO-M 15
MF 000
RAC 01
M 5 Powder
ZBM 52-999
McLube MoS2 98
McLube MoS2 100
McLube MoS2 99
ZWEZ-Lube MD 210
L-GPM 210
XT 0808-2-2
XF 184-1
XF 209
Liqui-Moly LM 12
ZBY 801
HD 7352
XT 0805-3-1
LM 12
Identifiers:
SMILES:
[Mo].[S].[S]
InChI:
InChI=1S/Mo.2S
Key Properties
Melting Point
2375 °C
CAS Common Chemistry
Density
5.06 g/cm³
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 | 160.07 g/mol | CAS Common Chemistry |
| 160.074 g/mol | RDKit | |
| 161.84955019999998 g/mol | RDKit | |
| Density | 5.06 g/cm³ | CAS Common Chemistry |
| 5.06 g/cm3 @ Temp: 15 °C | CAS Common Chemistry | |
| Wikipedia Url | https://en.wikipedia.org/wiki/Molybdenum_disulfide | CAS Common Chemistry |
| Canonical SMILES | S=[Mo]=S | CAS Common Chemistry |
| InChI | InChI=1S/Mo.2S | CAS Common Chemistry |
| InChI Key | InChIKey=CWQXQMHSOZUFJS-UHFFFAOYSA-N | CAS Common Chemistry |
| Melting Point | 2375 °C | CAS Common Chemistry |
| Name | Molybdenum disulfide | CAS Common Chemistry |
| Heavy Atom Count | 3 | RDKit |
| Hydrogen Bond Acceptors | 0 | RDKit |
| Hydrogen Bond Donors | 0 | RDKit |
| Rotatable Bonds | 0 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 0.0 Ų | RDKit |
| LogP | 1.2939 | RDKit |
| Molar Refractivity | 15.182 | RDKit |
