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2,5-Dimethylbenzophenone

HCID 77665
NotesReactions
Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
13319-70-5
Standard SMILES
Cc1cc(C)cc(C(=O)c2ccccc2)c1
InChIKey
OLXZWWMXQRMOGP-UHFFFAOYSA-N
Molecular formula
C15H14O
Average molar mass
210.27 g/mol

Names & identifiers

Preferred name
2,5-Dimethylbenzophenone
IUPAC
(3,5-dimethylphenyl)-phenylmethanone
English name
5-Benzoyl-M-xylene
Molecular formula
C15H14O
Molecular weight
210.27

Names & synonyms

13319-70-5(3,5-Dimethyl-phenyl)-phenyl-methanoneEINECS 223-740-8NSC 82305RefChem:444570223-740-8653-980-22,5-dimethylbenzophenone4044-60-4(3,5-dimethylphenyl)(phenyl)methanone5-Benzoyl-m-xylene(3,5-dimethylphenyl)-phenylmethanone
Show more names
Methanone, (3,5-dimethylphenyl)phenyl-
MFCD00185169(3,5-Dimethylphenyl)phenylmethanone3,5-DimethylbenzophenoneSCHEMBL14286947(3,5-dimethylphenyl)-phenyl-methanoneAKOS009339049AS-19597CS-0337809

Database identifiers

CAS
13319-70-5、4044-60-4
PubChem CID
77665
EC Number
223-740-8、653-980-2
Nikkaji
J2.963.283I

Properties

Computed structural properties

XLogP
4
Topological polar surface area
17.1 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
1
Rotatable bonds
2
Heavy atoms
16
Formal charge
0
Complexity
230

Physicochemical properties

Symbol(GHS)
9 · GHS09
Hazard statements
411 · H411

Safety & regulation

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

GHS classification

GHS Classification · 6 items

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 38 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

H411 (100%): Toxic to aquatic life with long lasting effects [Hazardous to the aquatic environment, long-term hazard]

P273, P391, and P501 (click each P-code to see the statement)

Hazard information

Hazard Classes and Categories · 2 items

Skin Irrit. 2 (100%)

Aquatic Chronic 2 (100%)

Safety data

Symbol(GHS)
GHS09
Hazard statements
H411

Chemistry & industry

Applications

Uses5-Benzoyl-m-xylene is a useful synthetic intermediate. It can be prepared by carbonylative Suzuki reactions.

Upstream & downstream products

Upstream raw materials

Benzene, 1,3-dimethyl-5-(1-phenylethenyl)-N-BenzoylsuccinimideBenzoic anhydride

Suppliers7 total

上海仲因实业有限公司2537653158 16621191650 · [email protected]
HANGZHOU LEAP CHEM CO., LTD.+86-571-87711850 +86-15355479329 · [email protected]
安耐吉化学&3A(安徽泽升科技股份有限公司)400-0056266 · [email protected]
深圳聚合生化科技有限公司+86-400-002-6226 13028896684 · [email protected]
江苏艾康生物医药研发有限公司025-58859352 17714375163 · [email protected]
珠海奥博凯生物医药技术有限公司400-0628126 · [email protected]
北京百灵威科技有限公司18210857532 18210857532 · [email protected]

Related reactions

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Compound notes

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