1,1-Dimethyl-2-(4-methoxyphenyl)ethylamine hydrochloride
Basic information
- CAS
56490-93-8- Standard SMILES
COc1ccc(CC(C)(C)N)cc1.Cl- InChIKey
BXOCBNXPOIPDTL-UHFFFAOYSA-N- Molecular formula
- C11H18ClNO
- Average molar mass
- 215.72 g/mol
- Monoisotopic mass
- 215.1076919
Names & identifiers
- Preferred name
- 1,1-Dimethyl-2-(4-methoxyphenyl)ethylamine hydrochloride
- IUPAC
- 1-(4-methoxyphenyl)-2-methylpropan-2-amine;hydrochloride
- English name
- Phenethylamine, alpha,alpha-dimethyl-p-methoxy-, hydrochloride
- Molecular weight
- 0
Names & synonyms
1,1-dimethyl-2-(4-methoxyphenyl)ethylamine hydrochlorideRefChem:409950816-308-056490-93-81-(4-methoxyphenyl)-2-methylpropan-2-amine hydrochlorideMFCD01708221Phenethylamine, alpha,alpha-dimethyl-p-methoxy-, hydrochloride1-(4-Methoxyphenyl)-2-methyl-2-propanamine Hydrochloride4-Methoxy-alpha,alpha-dimethylbenzeneethanamine hydrochlorideS 651-(4-methoxyphenyl)-2-methylpropan-2-amine HClSCHEMBL3800374
Show more names
Olodaterol Impurity 13 HClOlodaterol Impurity 11(Hydrochloride)1-heptan-4-yl-2-phenyl-1,2,4-triazolidine-3,5-dione
1-(4-methoxyphenyl)-2-methylpropan-2-amine;hydrochlorideDTXSID70971910BXOCBNXPOIPDTL-UHFFFAOYSA-NCPD0057-B3AC6367AKOS037654069KS-7995SB40417
Database identifiers
- CAS
56490-93-8- PubChem CID
- 91891
- DTXSID
DTXSID70971910- EC Number
- 816-308-0
Properties
Computed structural properties
- Topological polar surface area
- 35.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 148
Physicochemical properties
- Melting point
- 169 °C · 169 °C(Solv: ethanol (64-17-5); ethyl ether (60-29-7))
- storage temp.
- Store at room temperature, keep dry and cool
- Appearance
- White to off-white Solid
- InChI
- InChI=1S/C11H17NO.ClH/c1-11(2,12)8-9-4-6-10(13-3)7-5-9;/h4-7H,8,12H2,1-3H3;1H
- InChIKey
- BXOCBNXPOIPDTL-UHFFFAOYSA-N
- SMILES
- C1(CC(N)(C)C)C=CC(OC)=CC=1.Cl
- EWG's Food Scores
- 1 · 1
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
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 50% (1 of 2) of reports.
Warning
H315 (50%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 2 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 CategoriesSkin Irrit. 2 (50%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Related reactions
2 records
Compound notes
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