2,4-Dimethylphenethylamine
Basic information
- CAS
76935-60-9- Standard SMILES
Cc1ccc(CCN)c(C)c1- InChIKey
VQGZTRKXOUWMAC-UHFFFAOYSA-N- Molecular formula
- C10H15N
- Average molar mass
- 149.23 g/mol
- Monoisotopic mass
- 149.12044948
Names & identifiers
- Preferred name
- 2,4-Dimethylphenethylamine
- IUPAC
- 2-(2,4-dimethylphenyl)ethanamine
- English name
- 2,4-Dimethylphenethylamine
- Molecular formula
- C10H15N
- Molecular weight
- 149.23
Names & synonyms
76935-60-92,4-DimethylphenethylamineDTXSID40328836RefChem:246635DTXCID10279942674-222-72-(2,4-dimethylphenyl)ethanamine2-(2,4-dimethylphenyl)ethan-1-amineBenzeneethanamine,2,4-dimethyl-MFCD013108162,4-dimethylbenzeneethanamineBenzeneethanamine, 2,4-dimethyl-
Show more names
RARECHEM AL BW 0609[2-(2,4-Dimethylphenyl)ethyl]amine
SCHEMBL855681SCHEMBL30251350VQGZTRKXOUWMAC-UHFFFAOYSA-N2-(2,4-dimethylphenyl)ethylamineSBB0176452-(2,4-dimethyl-phenyl)-ethylamineAKOS000155206AT12706
Database identifiers
- CAS
76935-60-9- PubChem CID
- 414339
- DTXSID
DTXSID40328836- EC Number
- 674-222-7
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 26 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 2
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 111
Physicochemical properties
- Boiling point
- 95 °C · 95°C 10mm
- Density
- 0 · 0,95 g/cm3
- Flash point
- 101 ℃ · 101℃
- pka
- 10.03 · 10.03±0.10(Predicted)
- CAS DataBase Reference
- 76935 · 76935-60-9(CAS DataBase Reference)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 335 · H335-H319-H315
- Precautionary statements
- 264 · P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P
- Hazard Codes
- Xi,C
- Risk Statements
- 34 · 34-36
- Safety Statements
- 26 · 26-36/37/39
- RIDADR
- 2735 · 2735
- HazardClass
- IRRITANT-HARMFUL, CORROSIVE
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 (20%): Harmful if swallowed [Warning Acute toxicity, oral]
P260, P261, P264, P264+P265, P270, P271, P280, P301+P317, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P351+P338, P305+P354+P338, P316, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P363, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 5 reports by companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (20%)
Safety data
- ridadr
- 2735
- risk_code
- 34-36
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xi,C
- safety_code
- 26-36/37/39
- hazard_class
- IRRITANT-HARMFUL, CORROSIVE
- Hazard statements
- H335-H319-H315
- Precautionary statements
- P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P
Related reactions
1 records
Compound notes
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