1-Propanone, 1-(4-dodecylphenyl)-2-hydroxy-2-methyl-

HCID 112290

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Basic information

CAS: 69673-80-9
Standard SMILES: CCCCCCCCCCCCc1ccc(C(=O)C(C)(C)O)cc1
InChIKey: MLKIVXXYTZKNMI-UHFFFAOYSA-N
Molecular formula: C22H36O2
Average molar mass: 332.5 g/mol
Monoisotopic mass: 332.27153039

Names & identifiers

Preferred name: 1-Propanone, 1-(4-dodecylphenyl)-2-hydroxy-2-methyl-
IUPAC: 1-(4-dodecylphenyl)-2-hydroxy-2-methylpropan-1-one
English name: 1-(4-dodecylphenyl)-2-hydroxy-2-methylpropan-1-one
Molecular formula: C22H36O2
Molecular weight: 332.52

Names & synonyms

1-(4-Dodecylphenyl)-2-hydroxy-2-methylpropan-1-one69673-80-9EINECS 274-071-31-Propanone, 1-(4-dodecylphenyl)-2-hydroxy-2-methyl-1-(4-Dodecylphenyl)-2-hydroxy-2-methyl-1-propanoneDTXSID3071989RefChem:436298DTXCID7046542274-071-3Darocur 953SCHEMBL151548NS00036915

Show more names

4''-Dodecyl-2-hydroxy-2-methylpropiophenone

p-dodecyl-2-hydroxy-2,2-dimethylacetophenone1-(4-dodecylphenyl)-2-hydroxy-methyl propane-1-on1-(4-dodecyl-phenyl)-2-hydroxy-2-methylpropan-1-one1- (4-dodecylphenyl) -2-hydroxy-2-methylpropan-1-one

Database identifiers

CAS: 69673-80-9
PubChem CID: 112290
DTXSID: DTXSID3071989
EC Number: 274-071-3
Nikkaji: J318.018B

Properties

Computed structural properties

XLogP: 7.8
Topological polar surface area: 37.3 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 2
Rotatable bonds: 13
Heavy atoms: 24
Formal charge: 0
Complexity: 327

Physicochemical properties

EPA Substance Registry System: 1 · 1-Propanone, 1-(4-dodecylphenyl)-2-hydroxy-2-methyl- (69673-80-9)
Symbol(GHS): 7 · GHS07
Signal word: Warning
Hazard statements: 315 · H315-H319
Precautionary statements: 264 · P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P
TSCA: TSCA listed

Safety & regulation

GHS classification

GHS Classification · 6 items

This chemical does not meet GHS hazard criteria for 7.1% (1 of 14) of reports.

Warning

H315 (92.9%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (92.9%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]

P264, P264+P265, P280, P302+P352, P305+P351+P338, P321, P332+P317, P337+P317, and P362+P364 (click each P-code to see the statement)

Aggregated GHS information provided per 14 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.；Reported as not meeting GHS hazard criteria per 1 of 14 reports by companies.；There is 1 notification provided by 13 of 14 reports by companies with hazard statement code(s).；Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.

Hazard information

Regulatory InformationChemical: 1-Propanone, 1-(4-dodecylphenyl)-2-hydroxy-2-methyl-

Hazard Classes and CategoriesSkin Irrit. 2 (92.9%)；Eye Irrit. 2 (92.9%)

Regulatory information

Regulatory InformationChemical: 1-Propanone, 1-(4-dodecylphenyl)-2-hydroxy-2-methyl-

Safety data

tsca: TSCA listed
Signal word: Warning
Symbol(GHS): GHS07
Hazard statements: H315-H319
Precautionary statements: P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P