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CAS: 128-37-0 | C15H24O
2D Structure
3D Structure
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Basic Information
CAS Registry Number:
128-37-0
Molecular Formula:
C15H24O
Molecular Weight:
220.356 g/mol
Names and Synonyms:
Buks
Butylated Hydroxytoluene
Phenol, 2,6-bis(1,1-dimethylethyl)-4-methyl-
p-Cresol, 2,6-di-tert-butyl-
2,6-Bis(1,1-dimethylethyl)-4-methylphenol
CAO 1
CAO 3
Dalpac
DBPC
Deenax
2,6-Di-tert-butyl-p-methylphenol
4-Hydroxy-3,5-di-tert-butyltoluene
Impruvol
Ionol
Ionole
4-Methyl-2,6-di-tert-butylphenol
Parabar 441
Sustane BHT
Tenamene 3
Topanol OC
Vianol
BHT
Butylated hydroxytoluene
Topanol O
Topanol
Dibunol
Nonox TBC
AO 4K
Dibutylated hydroxytoluene
Ionol 1
2,6-Di-tert-butylcresol
Stavox
Di-tert-Butyl-4-methylphenol
o-Di-tert-butyl-p-methylphenol
Di-tert-butyl-p-cresol
Antioxidant KB
2,6-Di-tert-butyl-p-cresol
Antioxidant 4K
Sumilizer BHT
Di-tert-butylcresol
Catalin CAO 3
Chemanox 11
Vanlube PCX
Vanlube PC
Advastab 401
2,6-Di-tert-butyl-p-cresole
Antioxidant 29
AO 29
Antioxidant 30
P 21
Antioxidant DBPC
Agidol
Alkofen BP
Kerabit
Agidol 1
AO 4
Vulkanox KB
2,6-Di-tert-butylmethylphenol
Nocrac 200
2,6-Di-tert-butyl-4-hydroxytoluene
2,6-Di-tert-butyl-4-methyl-1-hydroxybenzene
Ionol BHT
AOX 4
AOX 4K
Antioxidant 4
Tenox BHT
Topanol BHT
Swanox BHT
2,6-Di-tert-butyl-4-methylhydroxybenzene
Antioxidant 264
Vanox PC
Antage BHT
3,5-Di-tert-butyl-4-hydroxytoluene
Popol
Ralox BHT
Permanax BHT
Antioxidant MPJ
Topanol OL
Naugard BHT
2,6-Di-tert-butyl-p-cresol
BAT
Ultranox 226
Lubrizol 817
2,6-Di-tert-butyl-4-methylphenol
P 21 (phenol)
T 501
Ionol 330
Yoshinox BHT
2,6-Bis(tert-butyl)-4-methylphenol
2,6-tert-Butyl-4-methylphenol
Antox QT
Ionol K
Ionol CP
4-Methyl-2,6-bis(1,1-dimethylethyl)phenol
T 501 (phenol)
Antioxidant T 501
BHT 264
Lowinox BHT
Selosol H 633
Tonarol
BHT-C
E 321
Dibutylcresol
Dibutylhydroxytoluene
NSC 6347
Nocrac 2000
2,6-Di-tert-butyl-4-cresol
Topanol O-FG
Sumilizer BHT-R
BHT Swanox
Agidol 1A
2,6-Di(tert-butyl)hydroxytoluene
B-NOX BHT-P
Nipanox
Antioxidant 246
K-NOX-BHT
3,5-Di-tert-butyl-p-hydroxytoluene
Grindox BHT
4-Methyl-2,6-ditertbutyl phenol
FG
Addiox 1005
2,6-Di-t-butyl-4-methylphenol
2,6-Ditertbutyl paracresol
Topanol C
2,6-Di-tert-butyl-p-cresol
Vulkanox BHT
Na-Lube AO 220
Dibutyl paracresol
Additin RC 1220
PN 01
M 4801
Antioxidant 501
BHT 501
Lavinix BHT
Nipanox BHT
H-BHT
Antioxidant OC
3,5-Bis(1,1-dimethylethyl)-4-hydroxytoluene
Antioxidant BHT
T 502A
NK-BHT
2,6-Di-tert-butyl-4-methyl phenol
Nocrac SP-N
AO 246
Chinox BHT
Antioxidant 502A
K-NOX BHT-P
Identifiers:
SMILES:
Cc1cc(C(C)(C)C)c(O)c(C(C)(C)C)c1
InChI:
InChI=1S/C15H24O/c1-10-8-11(14(2,3)4)13(16)12(9-10)15(5,6)7/h8-9,16H,1-7H3
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 |
|---|---|---|
| density | 1.05 g/cm³ | Legacy Database |
| wikipedia_url | https://en.wikipedia.org/wiki/Butylated_hydroxytoluene None | Legacy Database |
| cas-boiling-point | 265 °C None | Legacy Database |
| cas-canonical-smile | OC=1C(=CC(=CC1C(C)(C)C)C)C(C)(C)C None | Legacy Database |
| cas-density | 1.048 g/cm3 @ Temp: 20 °C None | Legacy Database |
| cas-inchi | InChI=1S/C15H24O/c1-10-8-11(14(2,3)4)13(16)12(9-10)15(5,6)7/h8-9,16H,1-7H3 None | Legacy Database |
| cas-inchi-key | InChIKey=NLZUEZXRPGMBCV-UHFFFAOYSA-N None | Legacy Database |
| cas-melting-point | 70 °C None | Legacy Database |
| cas-name | 2,6-Di-tert-butyl-4-methylphenol None | Legacy Database |
| wikipedia-name | Butylated hydroxytoluene None | Legacy Database |
| LogP | 4.295620000000004 | RDKit |
| molecular_mass | 220.36 g/mol | Legacy Database |
Molecular
| Property | Value | Source |
|---|---|---|
| Molecular Weight | 220.356 g/mol | RDKit |
Exact
| Property | Value | Source |
|---|---|---|
| Exact Molecular Weight | 220.182715388 g/mol | RDKit |
Heavy
| Property | Value | Source |
|---|---|---|
| Heavy Atom Count | 16 count | RDKit |
Hydrogen
| Property | Value | Source |
|---|---|---|
| Hydrogen Bond Acceptors | 1 count | RDKit |
| Hydrogen Bond Donors | 1 count | RDKit |
Rotatable
| Property | Value | Source |
|---|---|---|
| Rotatable Bonds | 0 count | RDKit |
Aromatic
| Property | Value | Source |
|---|---|---|
| Aromatic Ring Count | 1 count | RDKit |
Topological
| Property | Value | Source |
|---|---|---|
| Topological Polar Surface Area | 20.23 Ų | RDKit |
Molar
| Property | Value | Source |
|---|---|---|
| Molar Refractivity | 70.24380000000005 | RDKit |
