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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 Mass:
268.40 g/mol
Names and Synonyms:
6Ppd
1,4-Benzenediamine, N1-(1,3-dimethylbutyl)-N4-phenyl-
p-Phenylenediamine, N-(1,3-dimethylbutyl)-N′-phenyl-
1,4-Benzenediamine, N-(1,3-dimethylbutyl)-N′-phenyl-
N1-(1,3-Dimethylbutyl)-N4-phenyl-1,4-benzenediamine
N-(4-Methyl-2-pentyl)-N′-phenyl-p-phenylenediamine
Santoflex 13
N-(1,3-Dimethylbutyl)-N′-phenyl-p-phenylenediamine
Antioxidant 4020
N-Phenyl-N′-(1,3-dimethylbutyl)-p-phenylenediamine
Permanax 120
Wingstay 300
Diafen 13
Vulkanox 4020
Nocrac 6C
N-(1,3-Dimethylbutyl)-N′-phenyl-1,4-phenylenediamine
Flexzone 7L
Santoflex 13F
Antozite 67
Antozite 67F
Flexzone 7F
DBDA
UOP 562
UOP 588
Permanax 6PPD
DMBPD
CD 13
Dusantox 6PPD
Antioxidant CD 13
Antage 6C
Forte 6C
Diafen FDMB
N-Phenyl-N′-(1,3-dimethylbutyl)-1,4-phenylenediamine
Santoflex 6PPD
6PPD
Flexzone 7P
Vulkanox 4020LG
Pilflex 13
Accinox ZC
N-(1,3-Dimethylbutyl)-N′-phenyl-1,4-benzenediamine
4-(1,3-Dimethylbutylamino)diphenylamine
Ozonone 6C
CI
Luvomaxx 6PPD
Antigene 6C
Nocceler 6C
Antioxidant 6C
Kumanox 13
Antioxidant PD 2
PD 2
1-N-(4-Methylpentan-2-yl)-4-N-phenylbenzene-1,4-diamine
Kumanox 13C
Sunsine 6PPD
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
Key Properties
Melting Point
50 °C
CAS Common Chemistry
Density
1.07 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 | 268.40 g/mol | CAS Common Chemistry |
| 268.404 g/mol | RDKit | |
| 268.193948768 g/mol | RDKit | |
| Density | 1.07 g/cm³ | CAS Common Chemistry |
| 1.07 g/cm3 | CAS Common Chemistry | |
| Wikipedia Url | https://en.wikipedia.org/wiki/6PPD | CAS Common Chemistry |
| Canonical SMILES | C=1C=CC(=CC1)NC2=CC=C(C=C2)NC(C)CC(C)C | CAS Common Chemistry |
| 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 | CAS Common Chemistry |
| InChI Key | InChIKey=ZZMVLMVFYMGSMY-UHFFFAOYSA-N | CAS Common Chemistry |
| Melting Point | 50 °C | CAS Common Chemistry |
| Name | Antioxidant 4020 | CAS Common Chemistry |
| 6PPD | CAS Common Chemistry | |
| Heavy Atom Count | 20 | RDKit |
| Hydrogen Bond Acceptors | 2 | RDKit |
| Hydrogen Bond Donors | 2 | RDKit |
| Rotatable Bonds | 6 | RDKit |
| Aromatic Ring Count | 2 | RDKit |
| Topological Polar Surface Area | 24.06 Ų | RDKit |
| LogP | 5.2767000000000035 | RDKit |
| Molar Refractivity | 88.70640000000006 | RDKit |
