Methoxyphenone

HCID 38839
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Basic information

CAS
41295-28-7
Standard SMILES
COc1ccc(C(=O)c2cccc(C)c2)cc1C
InChIKey
BWPYBAJTDILQPY-UHFFFAOYSA-N
Molecular formula
C16H16O2
Average molar mass
240.3 g/mol
Monoisotopic mass
240.11502975

Names & identifiers

Preferred name
Methoxyphenone
IUPAC
(4-methoxy-3-methylphenyl)-(3-methylphenyl)methanone
English name
Methoxyphenone
Molecular formula
C16H16O2
Molecular weight
240.3

Names & synonyms

METHOXYPHENONE4-Methoxy-3,3'-dimethylbenzophenoneKayametoneNK 049(4-Methoxy-3-methylphenyl)(3-methylphenyl)methanone(4-methoxy-3-methylphenyl)-(3-methylphenyl)methanoneEINECS 255-300-6Methanone, (4-methoxy-3-methylphenyl)(3-methylphenyl)-UNII-0FKO9511Y1BRN 19668990FKO9511Y1DTXSID80194279
Show more names
NK-049PREMTENBrexpiprazole Impurity 121HEXACONAZOL PESTANAL, 100 MG4-METHOXY-3,3'-DIMETHYBENZOPHENONE3,3'-dimethyl-4-methoxybenzophenone4-methoxy-3,3’-dimethylbenzophenone
RefChem:157095DTXCID4011677041295-28-7(4-Methoxy-3-methylphenyl)(m-tolyl)methanoneMFCD00128925MethoxyphenonSCHEMBL51436orb1696131

Database identifiers

CAS
41295-28-7
PubChem CID
38839
DTXSID
DTXSID80194279
ChEMBL
CHEMBL2272262
ChEBI
CHEBI:82245
UNII
0FKO9511Y1
EC Number
255-300-6
Nikkaji
J1.894E

Properties

Computed structural properties

XLogP
4
Topological polar surface area
26.3 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
3
Heavy atoms
18

Physicochemical properties

Melting point
62.25 °C · 62.25°C
Boiling point
343.02 °C · 343.02°C (rough estimate)
Density
1.0752 · 1.0752 (rough estimate)
refractive index
1.6 · 1.6000 (estimate)
storage temp.
-20 °C · -20°C Freezer
solubility
Chloroform (Slightly), DMSO (Slightly)

Safety & regulation

GHS classification

GHS Classification · 3 items

H413 (100%): May cause long lasting harmful effects to aquatic life [Hazardous to the aquatic environment, long-term hazard]

P273, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 2 reports by companies from 1 notifications to the ECHA C&L Inventory.；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: Methanone, (4-methoxy-3-methylphenyl)(3-methylphenyl)-
Hazard Classes and CategoriesAquatic Chronic 4 (100%)

Regulatory information

Regulatory InformationChemical: Methanone, (4-methoxy-3-methylphenyl)(3-methylphenyl)-

Safety data

rtecs
PC4961000
hs_code
29143990
Hazard statements
H413

Chemistry & industry

Applications

UsesMethoxyphenone is a pesticidal compound, and it is used in preparation of Nitrones as herbicides.

Upstream & downstream products

Suppliers48 total

Shandong chuangyingchemical Co., Ltd.18853181302 · [email protected]
Hangzhou Collab Medicine Co.,Ltd.+86-15936229464 · [email protected]
Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
艾吉析科技（上海）有限公司17717235263 · [email protected]
Sichuan Biosynce Pharmatech Co., Ltd.[email protected]

Additional notes

DefinitionChEBI: Methoxyphenone is a member of benzophenones.

Related reactions

2 records
New reaction record

Compound notes

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