Basic information
- CAS
5285-60-9- Standard SMILES
CCC(C)Nc1ccc(Cc2ccc(NC(C)CC)cc2)cc1- InChIKey
YZZTZUHVGICSCS-UHFFFAOYSA-N- Molecular formula
- C21H30N2
- Average molar mass
- 310.5 g/mol
- Monoisotopic mass
- 310.24089897
Names & identifiers
- Preferred name
- Benzenamine, 4,4'-methylenebis[N-(1-methylpropyl)-
- IUPAC
- N-butan-2-yl-4-[[4-(butan-2-ylamino)phenyl]methyl]aniline
- English name
- 4,4'-methylenebis[N-sec-butylaniline]
- Molecular formula
- C21H30N2
- Molecular weight
- 310.48
Names & synonyms
5285-60-94,4'-Bis(sec-butylamino)diphenylmethaneEINECS 226-122-6Benzenamine, 4,4'-methylenebis[N-(1-methylpropyl)-DTXSID9041499Benzenamine, 4,4'-methylenebis(N-(1-methylpropyl)-RefChem:117224DTXCID70214994,4'-Methylenebis(N-(sec-butyl)aniline)4,4'-Methylenebis(N-sec-butylaniline)4,4'-methylenebis[N-sec-butylaniline]N-butan-2-yl-4-[[4-(butan-2-ylamino)phenyl]methyl]aniline
Show more names
MBDA4,4'-methylenebis[N-sec-butylanilineUnilink?4200ACETOSTAB 225POLYLINK 4200WANALINK? 6200N,N'-dibutyldiaminodiphenylmethane4,4'-methylenebis[N-sec-butylaniline]l4,4'-Di-sec-butylamino diphenylmethane
MFCD037034594,4'-Methylenebis[N-(sec-butyl)aniline]Tetracaine Impurity 34SCHEMBL48404AKOS0281084844,4'-methylene-bis[N-s-butylaniline]4,4\'-methylenebis[N-sec-butylaniline]AS-87340
Database identifiers
Properties
Computed structural properties
- XLogP
- 6.5
- Topological polar surface area
- 24.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 8
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 271
Experimental & physicochemical properties
Physical DescriptionCBI; Liquid
Physicochemical properties
- Boiling point
- 240 · 240-250 °C(Press: 2-3 Torr)
- Density
- 1.009 · 1.009±0.06 g/cm3(Predicted)
- vapor pressure
- 0 Pa · 0Pa at 25℃
- storage temp.
- 2 · 2-8°C, protect from light
- pka
- 6.23 · 6.23±0.39(Predicted)
- Appearance
- Colorless to light yellow Liquid
- Water Solubility
- 1.5 mg/L · 1.5mg/L at 20℃
- InChI
- InChI=1S/C21H30N2/c1-5-16(3)22-20-11-7-18(8-12-20)15-19-9-13-21(14-10-19)23-17(4)6-2/h7-14,16-17,22-23H,5-6,15H2,1-4H3
- InChIKey
- YZZTZUHVGICSCS-UHFFFAOYSA-N
- SMILES
- C(C1=CC=C(NC(C)CC)C=C1)C1=CC=C(NC(C)CC)C=C1
- LogP
- 5.4 at · 5.4 at 20℃
- EPA Substance Registry System
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
This chemical does not meet GHS hazard criteria for 2.2% (6 of 279) of reports.
Warning
H302 (97.8%): Harmful if swallowed [Warning Acute toxicity, oral]
P260, P261, P264, P270, P272, P273, P280, P301+P317, P302+P352, P319, P321, P330, P333+P317, P362+P364, P391, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 279 reports by companies from 14 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Regulatory Information
Chemical: Benzenamine, 4,4'-methylenebis[N-(1-methylpropyl)-
Benzenamine, 4,4'-methylenebis[N-(1-methylpropyl)- is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Benzenamine, 4,4'-methylenebis[N-(1-methylpropyl)- 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: 4,4'-methylenebis[N-sec-butylaniline] (EC: 226-122-6)
Benzenamine, 4,4'-methylenebis[N-(1-methylpropyl)-: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right.
Hazard Classes and CategoriesAcute Tox. 4 (97.8%)
Safety data
- tsca
- TSCA listed
- Signal word
- Warning
- Symbol(GHS)
- GHS08,GHS07,GHS09
- Hazard statements
- H410-H302-H373-H317
- REACH Registrations
Chemistry & industry
Uses & manufacturing
U.S. Production2023: 1,000,000 - <8,500,000 lb
Consumer UsesNot Known or Reasonably Ascertainable
Industry UsesNot Known or Reasonably Ascertainable
General Manufacturing Information
Not Known or Reasonably Ascertainable
Benzenamine, 4,4'-methylenebis[N-(1-methylpropyl)-: ACTIVE
Applications
Uses4,4'-methylenebis(N-sec-butylaniline) be used as epoxy curing agents.
Suppliers100 total
湖北永阔科技有限公司027-59223108 15972152991 · [email protected]
湖北万得化工有限公司15377098680 15377098680 · [email protected]
深圳市星凯越生物科技有限公司0755-18589069862 18589069862 · [email protected]
上海麦克林生化科技股份有限公司021-50706066 15221275939 · [email protected]
山东海舟生物工程有限公司130-0567-0367 13006570367 · [email protected]
武汉欣扬瑞和化学科技有限公司153-07155313 15307155313 · [email protected]
杭州品高化工有限公司0571-87658025 · [email protected]
上海腾准生物科技有限公司
Related reactions
3 records
Compound notes
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