1-(4-(Methoxymethyl)phenyl)ethan-1-one

HCID 89590

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Basic information

CAS: 22072-50-0
Standard SMILES: COCc1ccc(C(C)=O)cc1
InChIKey: WKGOPZYVTPKHLN-UHFFFAOYSA-N
Molecular formula: C10H12O2
Average molar mass: 164.2 g/mol
Monoisotopic mass: 164.08372962

Names & identifiers

Preferred name: 1-(4-(Methoxymethyl)phenyl)ethan-1-one
IUPAC: 1-[4-(methoxymethyl)phenyl]ethanone
English name: 1-[4-(methoxymethyl)phenyl]ethan-1-one
Molecular formula: C10H12O2
Molecular weight: 164.20108

Names & synonyms

22072-50-01-[4-(Methoxymethyl)phenyl]ethanone1-(4-(Methoxymethyl)phenyl)ethanone1-(4-(Methoxymethyl)phenyl)ethan-1-one1-[4-(METHOXYMETHYL)PHENYL]ETHAN-1-ONEEINECS 244-767-1DTXSID70176569RefChem:424459DTXCID1099060244-767-11-(4-Methoxymethylphenyl)ethanoneMFCD11553476

Show more names

Ethanone,1-[4-(methoxymethyl)phenyl]-Ethanone, 1-[4-(methoxymethyl)phenyl]-4-(Methoxymethyl)acetophenone4'-(Methoxymethyl)acetophenoneSCHEMBL1104605SCHEMBL93624611-(4-Methoxymethyl-phenyl)ethanoneXAA07250

Database identifiers

CAS: 22072-50-0
PubChem CID: 89590
DTXSID: DTXSID70176569
EC Number: 244-767-1
Nikkaji: J285.430I

Properties

Computed structural properties

XLogP: 1.4
Topological polar surface area: 26.3 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 2
Rotatable bonds: 3
Heavy atoms: 12
Formal charge: 0
Complexity: 146

Physicochemical properties

Symbol(GHS): 7 · GHS07
Signal word: Warning
Hazard statements: 319 · H319-H335-H302-H315
Precautionary statements: 264 · P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362-P264-P270-P301+P312-P330-P501

Safety & regulation

GHS classification

GHS Classification · 5 items

Warning

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]；H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+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%)；Skin Irrit. 2 (100%)；Eye Irrit. 2A (100%)；STOT SE 3 (100%)

Safety data

Signal word: Warning
Symbol(GHS): GHS07
Hazard statements: H319-H335-H302-H315
Precautionary statements: P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362-P264-P270-P301+P312-P330-P501