4,4'-Ethylenedi-3-toluidine
Basic information
- CAS
22856-62-8- Standard SMILES
Cc1cc(N)ccc1CCc1ccc(N)cc1C- InChIKey
ISESBQNCWCFFFR-UHFFFAOYSA-N- Molecular formula
- C16H20N2
- Average molar mass
- 240.34 g/mol
- Monoisotopic mass
- 240.16264864
Names & identifiers
- Preferred name
- 4,4'-Ethylenedi-3-toluidine
- IUPAC
- 4-[2-(4-amino-2-methylphenyl)ethyl]-3-methylaniline
- English name
- 4,4'-Diamino-2,2'-dimethylbibenzyl
- Molecular formula
- C16H20N2
- Molecular weight
- 240.34
Names & synonyms
4,4'-Ethylenedi-3-toluidine22856-62-8EINECS 245-268-1DTXSID20177400RefChem:506695DTXCID2099891245-268-154628-21-64,4'-Diamino-2,2'-dimethylbibenzyl4,4'-(Ethane-1,2-diyl)bis(3-methylaniline)4-[2-(4-amino-2-methylphenyl)ethyl]-3-methylaniline4,4'-Ethylenedi-m-toluidine
Show more names
LABOTEST-BB LT001596544,4'-Ethylenebis(3-methylaniline)2,2'-Dimethylbibenzyl-4,4'-diamine1,2-Bis(4-amino-2-methylphenyl)ethane4,4'-Diamino-2,2'-dimethylbibenzyl>4,4'-(Ethane-1,2-diyl)bis(3-methylaniline)Benzenamine, 4,4'-(1,2-ethanediyl)bis[3-methyl-4,4′-Diamino-2,2′-dimethylbibenzyl, CAS 54628-21-6
MFCD000078124-[2-(4-Amino-2-methylphenyl)ethyl]-3-methylphenylamine4,4 inverted exclamation mark -Diamino-2,2 inverted exclamation mark -dimethylbibenzylAU4C5GT5TWSCHEMBL865950ISESBQNCWCFFFR-UHFFFAOYSA-4,4'-diamino-2,2'dimethylbibenzylSBB057242
Database identifiers
- CAS
22856-62-8、54628-21-6- PubChem CID
- 89867
- DTXSID
DTXSID20177400- UNII
- AU4C5GT5TW
- EC Number
- 245-268-1
- Nikkaji
- J208.390F
Properties
Computed structural properties
- XLogP
- 3.5
- Topological polar surface area
- 52 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 227
Experimental & physicochemical properties
Endocrine DisruptorsPotential endocrine disrupting compound
Physicochemical properties
- Melting point
- 170 °C · 170 °C
- Boiling point
- 411 ℃ · 411℃
- Density
- 1.092 · 1.092
- Flash point
- 242 ℃ · 242℃
- form
- powder to crystal
- color
- White to Yellow to Orange
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302+H312+H332-H315-H319
- Precautionary statements
- 261 · P261-P264-P270-P271-P280-P301+P312+P330-P302+P352+P312+P362+P364-P304+P340+P312-P305+P351+P338+P337+P313-P501
- HS Code
- 2921.59 · 2921.59.8090
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, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 39 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety data
- hs_code
- 2921.59.8090
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302+H312+H332-H315-H319
- Precautionary statements
- P261-P264-P270-P271-P280-P301+P312+P330-P302+P352+P312+P362+P364-P304+P340+P312-P305+P351+P338+P337+P313-P501
Suppliers
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Related reactions
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Compound notes
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