[(4-Tert-butylphenyl)methyl](methyl)amine
Completing data — refresh the page later to see the latest
Basic information
- CAS
65542-26-9- Standard SMILES
CNCc1ccc(C(C)(C)C)cc1- InChIKey
ZSHCHOYJMLEAOX-UHFFFAOYSA-N- Molecular formula
- C12H19N
- Average molar mass
- 177.29 g/mol
- Monoisotopic mass
- 177.15174961
Names & identifiers
- Preferred name
- [(4-Tert-butylphenyl)methyl](methyl)amine
- IUPAC
- 1-(4-tert-butylphenyl)-N-methylmethanamine
- English name
- N-(4-TERT-BUTYLBENZYL)-N-METHYLAMINE
- Molecular formula
- C12H19N
- Molecular weight
- 177.29
Names & synonyms
[(4-tert-butylphenyl)methyl](methyl)amine((4-tert-butylphenyl)methyl)(methyl)amineRefChem:390229852-716-565542-26-9N-(4-tert-butylbenzyl)-N-methylamine1-(4-(tert-Butyl)phenyl)-N-methylmethanamine1-(4-tert-butylphenyl)-N-methylmethanamineN-methyl-4-tert-butylbenzylamineMFCD04623044SCHEMBL178541N-methyl-4-tert.butylbenzylamine
Show more names
N-(4-tert-butylbenzyl)methylamine(4-tert-Butylphenyl)methyl](methyl)amine(4-tert-butylphenyl)-N-methylmethanaminium4-(1,1-Dimethylethyl)-N-methylbenzenemethanamineBenzenemethanamine, 4-(1,1-dimethylethyl)-N-methyl-
DTXSID70368487ZSHCHOYJMLEAOX-UHFFFAOYSA-NHMS1747M11SBB089320AKOS005296655BS-52930{[4-(tert-butyl)phenyl]methyl}methylamineDB-073636
Database identifiers
- CAS
65542-26-9- PubChem CID
- 2396874
- DTXSID
DTXSID70368487- EC Number
- 852-716-5
- Nikkaji
- J1.627.378C
Properties
Computed structural propertiesFilling in
- XLogP
- 3
- Topological polar surface area
- 12 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 3
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 138
Physicochemical properties
- storage temp.
- Store at Room Tem.
- Symbol(GHS)
- 5 · GHS05,GHS07
- Signal word
- Danger
- Hazard statements
- 302 · H302-H314-H315-H318-H319-H335
- Precautionary statements
- 233 · P233-P235-P261-P280-P301+P330+P331-P302+P352-P304+P340-P305+P351+P338-P310
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
Danger
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P330, P332+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety data
- Signal word
- Danger
- Symbol(GHS)
- GHS05,GHS07
- Hazard statements
- H302-H314-H315-H318-H319-H335
- Precautionary statements
- P233-P235-P261-P280-P301+P330+P331-P302+P352-P304+P340-P305+P351+P338-P310
Related reactions
3 records
Compound notes
Loading…