Basic information
- CAS
3081-14-9- Standard SMILES
CC(C)CCC(C)Nc1ccc(NC(C)CCC(C)C)cc1- InChIKey
ZJNLYGOUHDJHMG-UHFFFAOYSA-N- Molecular formula
- C20H36N2
- Average molar mass
- 304.5 g/mol
- Monoisotopic mass
- 304.28784916
Overview
N,n'-bis(1,4-dimethylpentyl)-p-phenylenediamine is a deep red slightly viscous liquid with an aromatic odor. (NTP, 1992)
Names & identifiers
- Preferred name
- N,N'-bis(1,4-dimethylpentyl)-p-phenylenediamine
- IUPAC
- 1-N,4-N-bis(5-methylhexan-2-yl)benzene-1,4-diamine
- English name
- N,N'-Bis(1,4-dimethylpentyl)-p-phenylenediamine
- Molecular formula
- C20H36N2
- Molecular weight
- 304.51
Names & synonyms
N,N'-BIS(1,4-DIMETHYLPENTYL)-P-PHENYLENEDIAMINEEastozone1,4-Benzenediamine, N,N'-bis(1,4-dimethylpentyl)-CCRIS 4750UNII-8VAF71SNQ5EINECS 221-375-98VAF71SNQ5BRN 27390281,4-Benzenediamine, N1,N4-bis(1,4-dimethylpentyl)-N,N'-Bis-(1,4 dimethylpentyl)-p-phenylenediamineDTXSID2024618EC 221-375-9
Show more names
77PD77ppduop788tenamene4flexzone4lnci-c56337santoflex77eastozone33Unilink 7100
N,N'-Bis(1,4-dimethylpentyl)-4-phenylenediamineN,N'-bis(1,4-dimethylpentyl)-1,4-phenylenediamineN,N'-BIS(2-(5-METHYLHEXYL))-P-PHENYLENEDIAMINETenameneDHPPDRefChem:160919NAUGALUBE 443VULKANOX 4030
Database identifiers
- CAS
3081-14-9- PubChem CID
- 18320
Properties
Computed structural properties
- XLogP
- 6.8
- Topological polar surface area
- 24.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 10
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 239
Experimental & physicochemical properties
Density0.91 (NTP, 1992) - Less dense than water; will float
Solubilityless than 1 mg/mL at 75 °F (NTP, 1992)
Flash Pointgreater than 200 °F (NTP, 1992)
Boiling Point459 °F at 13.5 mmHg (NTP, 1992)
Melting Point-33 °F (NTP, 1992)
Physical Description
N,n'-bis(1,4-dimethylpentyl)-p-phenylenediamine is a deep red slightly viscous liquid with an aromatic odor. (NTP, 1992)
Liquid
Physicochemical properties
- Boiling point
- 435.32 °C · 435.32°C (rough estimate)
- Density
- 0.9452 · 0.9452 (rough estimate)
- vapor pressure
- 0 Pa · 0Pa at 25℃
- refractive index
- 1.645 · 1.6450 (estimate)
- solubility
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P270, P272, P273, P280, P301+P317, P302+P352, P321, P330, P333+P317, P362+P364, P391, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 58 reports by companies from 7 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Regulatory Information
Chemical: 1,4-Benzenediamine, N,N'-bis(1,4-dimethylpentyl)-
1,4-Benzenediamine, N1,N4-bis(1,4-dimethylpentyl)- is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of 1,4-Benzenediamine, N1,N4-bis(1,4-dimethylpentyl)- are required to report information about their production and use of this chemical to the EPA under the Toxic Substances Control Act (TSCA). (40 eCFR Part 711)
REACH registered substance: N,N'-bis(1,4-dimethylpentyl)-p-phenylenediamine (EC: 221-375-9)
1,4-Benzenediamine, N,N'-bis(1,4-dimethylpentyl)-: Does not have an individual approval but may be used under an appropriate group standard
Fire HazardsThis chemical is probably combustible. (NTP, 1992)
Health HazardsSYMPTOMS: Symptoms of exposure to this compound may include eye or skin irritation. (NTP, 1992)
Reactive GroupAmines, Aromatic
Reactivity Profile
N,N'-BIS(1,4-DIMETHYLPENTYL)-P-PHENYLENEDIAMINE may react with oxidizing agents (NTP, 1992). Neutralizes acids in exothermic reactions to form salts plus water. May be incompatible with isocyanates, halogenated organics, peroxides, phenols (acidic), epoxides, anhydrides, and acid halides. Flammable gaseous hydrogen may be generated in combination with strong reducing agents, such as hydrides.
Chemistry & industry
Uses & manufacturing
U.S. Production2023: 550,000 - <1,000,000 lb
Industry UsesAntioxidant
General Manufacturing Information
All Other Chemical Product and Preparation Manufacturing
1,4-Benzenediamine, N1,N4-bis(1,4-dimethylpentyl)-: ACTIVE
Applications
UsesN-Cyclohexyl-2-benzothiazyl sulphenamide is an intermediate in organic synthesis; an accelerator in natural and styrene-butadienethiazyl sulfenamide rubber.
General DescriptionDeep red slightly viscous liquid with an aromatic odor.
Suppliers55 total
郑州阿尔法化工有限公司+86-18530059196 · [email protected]
湖北永阔科技有限公司027-59223108 15972152991 · [email protected]
广州佳途科技股份有限公司81960175-877 18933936954 · [email protected]
杭州品高化工有限公司0571-87658025 · [email protected]
苏州市森菲达化工有限公司18796480002 18796480002 · [email protected]
上海赛可锐生物科技有限公司021-58000709 13120558703 · [email protected]
陕西纬宇新材料有限公司13772052144 13772052144 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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