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Stearyl Alcohol
CAS: 112-92-5 | C18H38O
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
112-92-5
Molecular Formula:
C18H38O
Molecular Mass:
270.50 g/mol
Names and Synonyms:
Stearyl Alcohol
1-Octadecanol
Atalco S
Crodacol S
Lorol 28
n-Octadecanol
Octadecyl alcohol
n-Octadecyl alcohol
Sipol S
Siponol S
Stearol
Stearyl alcohol
Steraffine
Adol 62
Siponol SC
Lanol S
Alfol 18
Cachalot S 43
Kalcohl 80
Conol 1675
Octadecanol
1-Hydroxyoctadecane
CO 1895F
Stearic alcohol
Rofamol
1-Stearyl alcohol
Lorol C 18
Adol 64
Adol 68
Alfol 18NF
Lanette 18DEO
Lanette 18
Kalcohl 8098
Laurex 18
CO 1895
Conol 30S
VLTN 6
Hyfatol 18-98
Hyfatol 18-95
CO 1897
NSC 5379
Conol 30SS
Crodacol S 95
Crodacol S 70
Crodacol S 95 NF
Kalchol 8098
Kalcohl 8099
Kalcol 8098
Conol 30F
Hainol 18SS
CO 1898
Nacol 18-98
Speziol C 18 Pharma
Kolliwax SA
Lanette-S 3
Tego Alkanol 18
Elocol C 1899
Nacol C 18
Crodacol S 95EP
Stearafine Pure
Stearyl alcohol NX
Ginol 18
Nacol 1898
Identifiers:
SMILES:
CCCCCCCCCCCCCCCCCCO
InChI:
InChI=1S/C18H38O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19/h19H,2-18H2,1H3
Key Properties
Boiling Point
210.5 °C @ Press: 15 Torr
CAS Common Chemistry
Melting Point
59.5 °C
CAS Common Chemistry
Density
0.81 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 | 270.50 g/mol | CAS Common Chemistry |
| 270.50099999999986 g/mol | RDKit | |
| 270.292265836 g/mol | RDKit | |
| Density | 0.81 g/cm³ | CAS Common Chemistry |
| 0.8124 g/cm3 @ Temp: 59 °C | CAS Common Chemistry | |
| Wikipedia Url | https://en.wikipedia.org/wiki/Stearyl_alcohol | CAS Common Chemistry |
| Boiling Point | 210.5 °C @ Press: 15 Torr | CAS Common Chemistry |
| Canonical SMILES | OCCCCCCCCCCCCCCCCCC | CAS Common Chemistry |
| InChI | InChI=1S/C18H38O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19/h19H,2-18H2,1H3 | CAS Common Chemistry |
| InChI Key | InChIKey=GLDOVTGHNKAZLK-UHFFFAOYSA-N | CAS Common Chemistry |
| Melting Point | 59.5 °C | CAS Common Chemistry |
| Name | Stearyl alcohol | CAS Common Chemistry |
| Heavy Atom Count | 19 | RDKit |
| Hydrogen Bond Acceptors | 1 | RDKit |
| Hydrogen Bond Donors | 1 | RDKit |
| Rotatable Bonds | 16 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 20.23 Ų | RDKit |
| LogP | 6.240200000000008 | RDKit |
| Molar Refractivity | 86.63180000000007 | RDKit |
