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6Ppd
CAS: 793-24-8 | C18H24N2
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
793-24-8
Molecular Formula:
C18H24N2
Molecular Weight:
268.404 g/mol
Names and Synonyms:
6Ppd
Sunsine 6PPD
Kumanox 13C
1-N-(4-Methylpentan-2-yl)-4-N-phenylbenzene-1,4-diamine
PD 2
Antioxidant PD 2
Kumanox 13
Antioxidant 6C
Nocceler 6C
Antigene 6C
Luvomaxx 6PPD
CI
Ozonone 6C
4-(1,3-Dimethylbutylamino)diphenylamine
N-(1,3-Dimethylbutyl)-N′-phenyl-1,4-benzenediamine
Accinox ZC
Pilflex 13
Vulkanox 4020LG
Flexzone 7P
6PPD
Santoflex 6PPD
N-Phenyl-N′-(1,3-dimethylbutyl)-1,4-phenylenediamine
Diafen FDMB
Forte 6C
Antage 6C
Antioxidant CD 13
Dusantox 6PPD
CD 13
DMBPD
Permanax 6PPD
UOP 588
UOP 562
DBDA
Flexzone 7F
Antozite 67F
Antozite 67
Santoflex 13F
Flexzone 7L
N-(1,3-Dimethylbutyl)-N′-phenyl-1,4-phenylenediamine
Nocrac 6C
Vulkanox 4020
Diafen 13
Wingstay 300
Permanax 120
N-Phenyl-N′-(1,3-dimethylbutyl)-p-phenylenediamine
Antioxidant 4020
N-(1,3-Dimethylbutyl)-N′-phenyl-p-phenylenediamine
Santoflex 13
N-(4-Methyl-2-pentyl)-N′-phenyl-p-phenylenediamine
N1-(1,3-Dimethylbutyl)-N4-phenyl-1,4-benzenediamine
1,4-Benzenediamine, N-(1,3-dimethylbutyl)-N′-phenyl-
p-Phenylenediamine, N-(1,3-dimethylbutyl)-N′-phenyl-
1,4-Benzenediamine, N1-(1,3-dimethylbutyl)-N4-phenyl-
Identifiers:
SMILES:
CC(C)CC(C)Nc1ccc(Nc2ccccc2)cc1
InChI:
InChI=1S/C18H24N2/c1-14(2)13-15(3)19-17-9-11-18(12-10-17)20-16-7-5-4-6-8-16/h4-12,14-15,19-20H,13H2,1-3H3
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 | 268.404 g/mol | RDKit |
Exact
| Property | Value | Source |
|---|---|---|
| Exact Molecular Weight | 268.193948768 g/mol | RDKit |
Heavy
| Property | Value | Source |
|---|---|---|
| Heavy Atom Count | 20 count | RDKit |
Hydrogen
| Property | Value | Source |
|---|---|---|
| Hydrogen Bond Acceptors | 2 count | RDKit |
| Hydrogen Bond Donors | 2 count | RDKit |
Rotatable
| Property | Value | Source |
|---|---|---|
| Rotatable Bonds | 6 count | RDKit |
Aromatic
| Property | Value | Source |
|---|---|---|
| Aromatic Ring Count | 2 count | RDKit |
Topological
| Property | Value | Source |
|---|---|---|
| Topological Polar Surface Area | 24.06 Ų | RDKit |
Physical Properties
| Property | Value | Source |
|---|---|---|
| LogP | 5.2767000000000035 | RDKit |
| molecular_mass | 268.40 g/mol | Legacy Database |
| density | 1.07 g/cm³ | Legacy Database |
| wikipedia_url | https://en.wikipedia.org/wiki/6PPD None | Legacy Database |
| cas-canonical-smile | C=1C=CC(=CC1)NC2=CC=C(C=C2)NC(C)CC(C)C None | Legacy Database |
| cas-density | 1.07 g/cm3 None | Legacy Database |
| cas-inchi | InChI=1S/C18H24N2/c1-14(2)13-15(3)19-17-9-11-18(12-10-17)20-16-7-5-4-6-8-16/h4-12,14-15,19-20H,13H2,1-3H3 None | Legacy Database |
| cas-inchi-key | InChIKey=ZZMVLMVFYMGSMY-UHFFFAOYSA-N None | Legacy Database |
| cas-melting-point | 50 °C None | Legacy Database |
| cas-name | Antioxidant 4020 None | Legacy Database |
| wikipedia-name | 6PPD None | Legacy Database |
Molar
| Property | Value | Source |
|---|---|---|
| Molar Refractivity | 88.70640000000006 | RDKit |
