[2-(3-Bromophenoxy)ethyl]dimethylamine

HCID 413371

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Basic information

CAS: 221915-84-0
Standard SMILES: CN(C)CCOc1cccc(Br)c1
InChIKey: ITRIRBFNZOUJEP-UHFFFAOYSA-N
Molecular formula: C10H14BrNO
Average molar mass: 244.13 g/mol
Monoisotopic mass: 243.02587617

Names & identifiers

Preferred name: [2-(3-Bromophenoxy)ethyl]dimethylamine
IUPAC: 2-(3-bromophenoxy)-N,N-dimethylethanamine
English name: 3-(2-DIMETHYLAMINOETHOXY)-BROMOBENZENE
Molecular formula: C10H14BrNO
Molecular weight: 244.13

Names & synonyms

[2-(3-bromophenoxy)ethyl]dimethylamine(2-(3-bromophenoxy)ethyl)dimethylamineRefChem:394909835-225-02-(3-bromophenoxy)-N,N-dimethylethanamine221915-84-0MFCD039935472-(3-bromophenoxy)-N,N-dimethylethan-1-amine3-(2-Dimethylaminoethoxy)-bromobenzene[2-(3-Bromo-phenoxy)-ethyl]-dimethyl-amineEthanamine, 2-(3-bromophenoxy)-N,N-dimethyl-SCHEMBL1129189

Show more names

CHEMBL1624592DTXSID70328708ITRIRBFNZOUJEP-UHFFFAOYSA-NWIA91584UKRORGSYN-BB BBV-070799AKOS000176723CS-11379DA-17443

Database identifiers

CAS: 221915-84-0
PubChem CID: 413371
DTXSID: DTXSID70328708
ChEMBL: CHEMBL1624592
EC Number: 835-225-0

Properties

Computed structural properties

XLogP: 2.6
Topological polar surface area: 12.5 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 2
Rotatable bonds: 4
Heavy atoms: 13
Formal charge: 0
Complexity: 141

Physicochemical properties

Boiling point: 280 · 280.0±20.0 °C(Predicted)
Density: 1.309 · 1.309±0.06 g/cm3(Predicted)
storage temp.: Sealed in dry,Room Temperature
pka: 8 · 8+-.0.28(Predicted)
Appearance: Colorless to light yellow Liquid
Symbol(GHS): 7 · GHS07,GHS05
Signal word: Danger
Hazard statements: 315 · H315-H302-H318-H335
Precautionary statements: 280 · P280-P305+P351+P338-P310-P264-P280-P302+P352-P321-P332+P313-P362-P264-P270-P301+P312-P330-P501

Safety & regulation

GHS classification

GHS Classification · 4 items

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): GHS07,GHS05
Hazard statements: H315-H302-H318-H335
Precautionary statements: P280-P305+P351+P338-P310-P264-P280-P302+P352-P321-P332+P313-P362-P264-P270-P301+P312-P330-P501