[2-(2-Methoxyphenoxy)ethyl](methyl)amine
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Basic information
- CAS
72955-82-9- Standard SMILES
CNCCOc1ccccc1OC- InChIKey
VOIPEKOXTFLQNY-UHFFFAOYSA-N- Molecular formula
- C10H15NO2
- Average molar mass
- 181.23 g/mol
- Monoisotopic mass
- 181.11027872
Names & identifiers
- Preferred name
- [2-(2-Methoxyphenoxy)ethyl](methyl)amine
- IUPAC
- 2-(2-methoxyphenoxy)-N-methylethanamine
- English name
- 2-(2-METHOXYPHENOXY)-N-METHYLETHYLAMINE
- Molecular formula
- C10H15NO2
- Molecular weight
- 181.23
Names & synonyms
[2-(2-methoxyphenoxy)ethyl](methyl)amine(2-(2-methoxyphenoxy)ethyl)(methyl)amineRefChem:394875676-935-92-(2-methoxyphenoxy)-N-methylethanamine72955-82-92-(2-Methoxyphenoxy)-N-methylethylamine[2-(2-Methoxy-phenoxy)-ethyl]-methyl-amineMFCD07400597[2-(2-methoxyphenoxy)ethyl]methylamine2-(2-methoxyphenoxy)-N-methyl-ethanamineSCHEMBL6192822
Show more names
Carvedilol Impurity 54Carvedilol Impurity 47Carvedilol Impurity 322-(2-Methoxyphenoxy)-N-methylethylaminN-methyl-2-(2-methoxyphenoxy)ethylamineEthanamine, 2-(2-methoxyphenoxy)-N-methyl-2- ( 2 - methoxyphenoxy ) -N - methylethan - 1 - amine2-(2-methoxyphenoxy)-N-methylethanamine(SALTDATA: FREE)
SCHEMBL7387774SCHEMBL9125414CHEMBL4587428DTXSID80424528VOIPEKOXTFLQNY-UHFFFAOYSA-NSBB027282STL302608AKOS000302330
Database identifiers
- CAS
72955-82-9- PubChem CID
- 6485441
- DTXSID
DTXSID80424528- ChEMBL
CHEMBL4587428- EC Number
- 676-935-9
Properties
Computed structural propertiesFilling in
- XLogP
- 1.2
- Topological polar surface area
- 30.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 130
Physicochemical properties
- storage temp.
- 2 · 2-8°C
- Appearance
- Light yellow to yellow Liquid
- InChI
- InChI=1S/C10H15NO2/c1-11-7-8-13-10-6-4-3-5-9(10)12-2/h3-6,11H,7-8H2,1-2H3
- InChIKey
- VOIPEKOXTFLQNY-UHFFFAOYSA-N
- SMILES
- C(NC)COC1=CC=CC=C1OC
- CAS DataBase Reference
- 72955 · 72955-82-9
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319-H335
- Precautionary statements
- 261 · P261-P280a-P304+P340-P305+P351+P338-P405-P501a
- HS Code
- 2922190090 · 2922190090
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
H315 (100%): 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 5 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 (100%)
Safety data
- hs_code
- 2922190090
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H315-H319-H335
- Precautionary statements
- P261-P280a-P304+P340-P305+P351+P338-P405-P501a
Related reactions
3 records
Compound notes
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