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Propylene Oxide
CAS: 75-56-9 | C3H6O
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
75-56-9
Molecular Formula:
C3H6O
Names and Synonyms:
Propylene Oxide
Chemogas NV
rac-Propylene oxide
Propozone
(±)-1,2-Epoxypropane
(±)-Propylene oxide
(±)-Epoxypropane
(±)-2-Methyloxirane
(±)-Methyloxirane
DL-1,2-Epoxypropane
dl-Propylene oxide
Epihydrin
Methyloxacyclopropane
AD 6
AD 6 (suspending agent)
Propylene epoxide
2,3-Epoxypropane
Methyloxirane
Epoxypropane
1,2-Propylene oxide
Propene oxide
1,2-Epoxypropane
2-Methyloxirane
Oxypropylene
Propane, 1,2-epoxy-
Propylene oxide
Oxirane, methyl-
Oxirane, 2-methyl-
Identifiers:
SMILES:
CC1CO1
InChI:
InChI=1S/C3H6O/c1-3-2-4-3/h3H,2H2,1H3
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 | 58.08 g/mol | RDKit |
| Exact | 58.041864812 g/mol | RDKit |
| Heavy | 4 count | RDKit |
| Hydrogen | 1 count | RDKit |
| 0 count | RDKit | |
| Rotatable | 0 count | RDKit |
| Aromatic | 0 count | RDKit |
| Topological | 12.53 Ų | RDKit |
| Physical Properties | 0.4051 | RDKit |
| 58.08 g/mol | Legacy Database | |
| 0.80 g/cm³ | Legacy Database | |
| https://en.wikipedia.org/wiki/Propylene_oxide | Legacy Database | |
| 34.23 °C | Legacy Database | |
| O1CC1C | Legacy Database | |
| 0.8 g/cm3 | Legacy Database | |
| InChI=1S/C3H6O/c1-3-2-4-3/h3H,2H2,1H3 | Legacy Database | |
| InChIKey=GOOHAUXETOMSMM-UHFFFAOYSA-N | Legacy Database | |
| -112.13 °C | Legacy Database | |
| (±)-Propylene oxide | Legacy Database | |
| Propylene oxide | Legacy Database | |
| Molar | 15.414000000000001 | RDKit |
Related Molecules
Other compounds with formula C3H6O
