p-(2-(Dimethylamino)ethoxy)benzaldehyde

HCID 84823CAS 15182-92-0

Substructure search Find similar structures

Basic information

Standard SMILES: CN(C)CCOc1ccc(C=O)cc1
InChIKey: CBOKAZFQZOQTOC-UHFFFAOYSA-N
Molecular formula: C11H15NO2
Average molar mass: 193.24 g/mol
Monoisotopic mass: 193.11027872

Names & identifiers

Preferred name: p-(2-(Dimethylamino)ethoxy)benzaldehyde
IUPAC: 4-[2-(dimethylamino)ethoxy]benzaldehyde
English name: 4-[2-(Dimethylamino)ethoxy]benzaldehyde
Molecular formula: C11H15NO2
Molecular weight: 193.24

Names & synonyms

15182-92-04-[2-(dimethylamino)ethoxy]benzaldehyde4-(2-(Dimethylamino)ethoxy)benzaldehydep-(2-(Dimethylamino)ethoxy)benzaldehydeP-[2-(dimethylamino)ethoxy]benzaldehydeEINECS 239-234-5DTXSID30164886RefChem:857919DTXCID4087377239-234-5MFCD07368978p-[2-(Dimethylamino)ethoxy]benzaldehyde;

Show more names

AKOS BC-2175CHEMBRDG-BB 4003884TIMTEC-BB SBB010890Benzaldehyde, 4-[2-(diMethylaMino)ethoxy]-4-[2-(Dimethylamino)ethoxy]benzaldehyde 95%4-[2-(dimethylamino)ethoxy]benzaldehyde(SALTDATA: FREE)1-[3,4-dihydroxy-5-(hydroxymethyl)-2-oxolanyl]quinazoline-2,4-dione

SCHEMBL209831SCHEMBL2958271SBB0108904-(2-dimethylaminoethoxy)benzaldehydeAKOS0001034654-(2-Dimethylamino-ethoxy)benzaldehydeDS-28824-(N,N-dimethylaminoethoxy)benzaldehyde

Database identifiers

CAS: 15182-92-0
PubChem CID: 84823
DTXSID: DTXSID30164886
EC Number: 239-234-5
Nikkaji: J218.365J

Properties

Computed structural properties

XLogP: 1.4
Topological polar surface area: 29.5 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 3
Rotatable bonds: 5
Heavy atoms: 14
Formal charge: 0
Complexity: 163

Experimental & physicochemical properties

Endocrine DisruptorsPotential endocrine disrupting compound

Physicochemical properties

Boiling point: 142 °C · 142 °C
Density: 1.062 · 1.062±0.06 g/cm3(Predicted)
storage temp.: 2 · under inert gas (nitrogen or Argon) at 2-8°C
solubility: Chloroform (Sparingly), DMSO (Sparingly)
pka: 8.55 · 8.55±0.28(Predicted)
form: Oil
color: Brown to Dark Brown
Symbol(GHS): 7 · GHS07
Signal word: Warning
Hazard statements: 315 · H315-H319-H227
Precautionary statements: 501 · P501-P210-P264-P280-P302+P352-P370+P378-P337+P313-P305+P351+P338-P362+P364-P332+P313-P403+P235
Hazard Codes: C,Xi
Hazard Note: Corrosive
HazardClass: IRRITANT
HS Code: 2912490090 · 2912490090

Safety & regulation

GHS classification

GHS Classification · 5 items

This chemical does not meet GHS hazard criteria for 25% (1 of 4) of reports.

Danger

H302 (50%): Harmful if swallowed [Warning Acute toxicity, oral]

P261, P264, P264+P265, P270, P271, P272, P280, P301+P317, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P330, P332+P317, P333+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 4 reports by companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Hazard information

Hazard Classes and CategoriesAcute Tox. 4 (50%)

Safety data

hs_code: 2912490090
Signal word: Warning
Symbol(GHS): GHS07
hazard_code: C,Xi
hazard_note: Corrosive
hazard_class: IRRITANT
Hazard statements: H315-H319-H227
Precautionary statements: P501-P210-P264-P280-P302+P352-P370+P378-P337+P313-P305+P351+P338-P362+P364-P332+P313-P403+P235