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Benzophenone, 3-methoxy-4'-methyl-

HCID 54881
NotesReactions
Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

CAS
82520-37-4
Standard SMILES
COc1cccc(C(=O)c2ccc(C)cc2)c1
InChIKey
KZQIJMIURWFUIS-UHFFFAOYSA-N
Molecular formula
C15H14O2
Average molar mass
226.27 g/mol
Monoisotopic mass
226.09937969

Names & identifiers

Preferred name
Benzophenone, 3-methoxy-4'-methyl-
IUPAC
(3-methoxyphenyl)-(4-methylphenyl)methanone
English name
3-Methoxy-4'-methylbenzophenone
Molecular formula
C15H14O2
Molecular weight
226.27

Names & synonyms

3-Methoxy-4'-methylbenzophenone82520-37-4BENZOPHENONE, 3-METHOXY-4'-METHYL-BRN 2581781DTXSID30231825Diphenylketone, 4-methyl-3'-methoxy-RefChem:328138DTXCID60154316KZQIJMIURWFUIS-UHFFFAOYSA-N(3-Methoxyphenyl)(4-methylphenyl)methanone(3-methoxyphenyl)(p-tolyl)methanone(3-methoxyphenyl)-(4-methylphenyl)methanone
Show more names
OTAVA-BB 1044025
MFCD01311558Methanone, (3-methoxyphenyl)(4-methylphenyl)-SCHEMBL19867974-methyl-3'-methoxybenzophenone(3-methoxyphenyl)-(p-tolyl)methanoneAKOS009346836CS-0235344(3-Methoxyphenyl)(4-methylphenyl)methanone #

Database identifiers

CAS
82520-37-4
PubChem CID
54881
DTXSID
DTXSID30231825
Nikkaji
J2.360.638K

Properties

Computed structural properties

XLogP
3.9
Topological polar surface area
26.3 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
3
Heavy atoms
17
Formal charge
0
Complexity
254

Physicochemical properties

Melting point
48.1 · 48.1-49.0 °C
Boiling point
145 · 145-150°C at 0.6 mm Hg
Density
1.088 · 1.088±0.06 g/cm3(Predicted)
storage temp.
Store at Room Tem.
solubility
Dichloromethane, Ethyl Acetate, Methanol
form
Oil
color
Viscus Yellow
Symbol(GHS)
7 · GHS07
Signal word
Warning
Hazard statements
315 · H315-H319-H335
Precautionary statements
264 · P264-P280-P302+P352-P321-P332+P313-P362-P305+P351+P338-P337+P313-P261-P271-P304+P340-P312-P403+P233-P405-P501

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

Safety data

Signal word
Warning
Symbol(GHS)
GHS07
Hazard statements
H315-H319-H335
Precautionary statements
P264-P280-P302+P352-P321-P332+P313-P362-P305+P351+P338-P337+P313-P261-P271-P304+P340-P312-P403+P233-P405-P501

Chemistry & industry

Applications

Uses3-Methoxy-4’-methylbenzophenone (cas# 82520-37-4) is a compound useful in organic synthesis.

Preparation methods

PreparationComplex preparation: Tandem catalysis access to ketones from aldehydes and –arylboronic acids via rhodium-catalyzed addition/oxidation.

Upstream & downstream products

Downstream products

rac-4-(3'-Methoxy-α-chlorobenzyl)-N,N-diethylbenzamideSNC 804-(3-Methoxybenzoyl)benzoic acid

Suppliers7 total

安耐吉化学&3A(安徽泽升科技有限公司)021-58432009 400-005-6266 · [email protected]
苏州爱玛特生物科技有限公司0512-56316828 4008675858 · [email protected]
凯试(上海)科技有限公司021-50135380 · [email protected]
深圳聚合生化科技有限公司+86-400-002-6226 13028896684 · [email protected]
北京百灵威科技有限公司18210857532 18210857532 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
珠海奥博凯生物医药技术有限公司

Related reactions

2 records
New reaction record
HRID 1553883 reaction equation
HRID 1553883As productTraining data from https://doi.org/10.1039/C8SC04228D (1/10)
HRID 1912340 reaction equation
HRID 1912340As productuspto-grants-2013_12

Compound notes

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On this pageBasic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
400-0628126 · [email protected]