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Cetyl Alcohol
CAS: 36653-82-4 | C16H34O
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
36653-82-4
Molecular Formula:
C16H34O
Molecular Weight:
242.44699999999992 g/mol
Names and Synonyms:
Cetyl Alcohol
Common Name
Cetylic alcohol
Synonym
Cetalol CA
Synonym
Cetal
Synonym
Nafol 16
Synonym
Kalcol 6028
Synonym
Ginol 16
Synonym
Spermol
Synonym
Crodacol C 90
Synonym
1-Hydroxyhexadecane
Synonym
Conol 1670
Synonym
Cetanol 70
Synonym
Nacol 16-95
Synonym
Kolliwax CA
Synonym
Speziol C 16
Synonym
Cetanol NX
Synonym
Nacol 16-99
Synonym
n-Hexadecyl alcohol
Synonym
Lanette 1665
Synonym
Lorol C 14/98
Synonym
Hainol 16SS
Synonym
Kalcol 6098
Synonym
Nacol 1618
Synonym
Cetyl Alcohol NX
Synonym
Crodacol C 95
Synonym
Lipocol C
Synonym
CO 1695F
Synonym
NAA 44
Synonym
Kalcohl 6098
Synonym
Alfol 16RD
Synonym
NSC 4194
Synonym
Hyfatol 16-95
Synonym
Hyfatol 16-85
Synonym
Conol 1695
Synonym
Lanette 16
Synonym
Tego Alkanol 16
Synonym
Cetalcos
Synonym
Laurex 16
Synonym
Epal 16
Synonym
CO 1695
Synonym
Lorol C 16
Synonym
1-Cetanol
Synonym
Kalcohl 60
Synonym
Palmitic alcohol
Synonym
Hyfatol 16
Synonym
Cachalot C 51
Synonym
Alfol 16
Synonym
Crodacol C
Synonym
Loxanwax SK
Synonym
Hexadecyl alcohol
Synonym
Hexadecanol
Synonym
Adol 52
Synonym
Product 308
Synonym
Palmityl alcohol
Synonym
Loxanol K extra
Synonym
Loxanol K
Synonym
Lorol 24
Synonym
n-Hexadecanol
Synonym
Ethol
Synonym
Ethal
Synonym
Crodacol CAT
Synonym
Crodacol CAS
Synonym
Cetylol
Synonym
Cetaffine
Synonym
Atalco C
Synonym
n-Cetyl alcohol
Synonym
Adol 52NF
Synonym
n-1-Hexadecanol
Synonym
Cetanol
Synonym
Siponol Wax A
Synonym
Siponol CC
Synonym
Cetyl alcohol
Synonym
Adol 54
Synonym
Elfacos C
Synonym
Lanol C
Synonym
1-Hexadecanol
Synonym
Identifiers:
SMILES:
CCCCCCCCCCCCCCCCO
InChI:
InChI=1S/C16H34O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17/h17H,2-16H2,1H3
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
Molecular
| Property | Value | Source |
|---|---|---|
| Molecular Weight | 242.44699999999992 g/mol | RDKit |
Exact
| Property | Value | Source |
|---|---|---|
| Exact Molecular Weight | 242.26096570800001 g/mol | RDKit |
Heavy
| Property | Value | Source |
|---|---|---|
| Heavy Atom Count | 17 count | RDKit |
Hydrogen
| Property | Value | Source |
|---|---|---|
| Hydrogen Bond Acceptors | 1 count | RDKit |
| Hydrogen Bond Donors | 1 count | RDKit |
Rotatable
| Property | Value | Source |
|---|---|---|
| Rotatable Bonds | 14 count | RDKit |
Aromatic
| Property | Value | Source |
|---|---|---|
| Aromatic Ring Count | 0 count | RDKit |
Topological
| Property | Value | Source |
|---|---|---|
| Topological Polar Surface Area | 20.23 Ų | RDKit |
Physical Properties
| Property | Value | Source |
|---|---|---|
| LogP | 5.460000000000006 | RDKit |
| cas-boiling-point | 334 °C @ Press: 760 Torr None | Legacy Database |
| cas-canonical-smile | OCCCCCCCCCCCCCCCC None | Legacy Database |
| molecular_mass | 242.45 g/mol | Legacy Database |
| density | 0.82 g/cm³ | Legacy Database |
| wikipedia_url | https://en.wikipedia.org/wiki/Cetyl_alcohol None | Legacy Database |
| cas-density | 0.8187 g/cm3 @ Temp: 50 °C None | Legacy Database |
| cas-inchi | InChI=1S/C16H34O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17/h17H,2-16H2,1H3 None | Legacy Database |
| cas-inchi-key | InChIKey=BXWNKGSJHAJOGX-UHFFFAOYSA-N None | Legacy Database |
| cas-melting-point | 49.3 °C None | Legacy Database |
| cas-name | Cetyl alcohol None | Legacy Database |
| wikipedia-name | Cetyl alcohol None | Legacy Database |
Molar
| Property | Value | Source |
|---|---|---|
| Molar Refractivity | 77.39780000000006 | RDKit |