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3,4-Dimethylbenzophenone - 99%, high purity , CAS No.2571-39-3

COA

Grade & Purity:

≥99%

Cas Number: 2571-39-3
Molecular Weight: 210.27
Beilstein Registry Number: 7(4)1433
EC Number: 219-916-9
MDL number: MFCD00008525
PubChem CID: 75730
PubChem SID: 504754985

In stock

Item Number

D106332

Grouped product items
SKU	Size	Availability	Price
D106332-25g	25g	1	$39.90
D106332-100g	100g	Available within 4-8 weeks(?) Items will be manufactured post-order and can take 4-8 weeks. Thank you for your patience!	$143.90
D106332-500g	500g	Available within 4-8 weeks(?) Items will be manufactured post-order and can take 4-8 weeks. Thank you for your patience!	$646.90

View related series

ketone (798) Non heterocyclic block (8163)

Basic Description

Synonyms	DS-4965 \| MFCD00008525 \| W-107223 \| InChI=1/C15H14O/c1-11-8-9-14(10-12(11)2)15(16)13-6-4-3-5-7-13/h3-10H,1-2H3 \| AKOS001046622 \| JENOLWCGNVWTJN-UHFFFAOYSA- \| NSC 10172 \| (3,4-Dimethylphenyl)(phenyl)methanone \| Benzophenone, 3,4-dimethyl- \| FT-0614375 \| NC
Specifications & Purity	≥99%
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Benzenoids
  - Class Benzene and substituted derivatives
    - Subclass Benzophenones

Kingdom	Organic compounds
Superclass	Benzenoids
Class	Benzene and substituted derivatives
Subclass	Benzophenones
Intermediate Tree Nodes	Not available
Direct Parent	Benzophenones
Alternative Parents	Diphenylmethanes Aryl-phenylketones o-Xylenes Benzoyl derivatives Organic oxides Hydrocarbon derivatives
Molecular Framework	Aromatic homomonocyclic compounds
Substituents	Benzophenone - Aryl-phenylketone - Diphenylmethane - O-xylene - Xylene - Aryl ketone - Benzoyl - Ketone - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Aromatic homomonocyclic compound
Description	This compound belongs to the class of organic compounds known as benzophenones. These are organic compounds containing a ketone attached to two phenyl groups.
External Descriptors	Not available
1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61. DOI: 10.1186/s13321-016-0174-y

Names and Identifiers

Pubchem Sid	504754985
Pubchem Sid Url	https://pubchem.ncbi.nlm.nih.gov/substance/504754985
IUPAC Name	(3,4-dimethylphenyl)-phenylmethanone
INCHI	InChI=1S/C15H14O/c1-11-8-9-14(10-12(11)2)15(16)13-6-4-3-5-7-13/h3-10H,1-2H3
InChIKey	JENOLWCGNVWTJN-UHFFFAOYSA-N
Smiles	CC1=C(C=C(C=C1)C(=O)C2=CC=CC=C2)C
Isomeric SMILES	CC1=C(C=C(C=C1)C(=O)C2=CC=CC=C2)C
WGK Germany	3
Molecular Weight	210.27
Beilstein	7(4)1433
Reaxy-Rn	1952043
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1952043&ln=

Certificates（CoA,COO,BSE/TSE and Analysis Chart)

C of A & Other Certificates(BSE/TSE, COO):

Analytical Chart:

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6 results found

Lot Number	Certificate Type	Date	Item
E1708019	Certificate of Analysis	Jan 20, 2025	D106332
K2425232	Certificate of Analysis	Jun 18, 2024	D106332
K2425233	Certificate of Analysis	Jun 18, 2024	D106332
K2425289	Certificate of Analysis	Jun 18, 2024	D106332
A2329054	Certificate of Analysis	Jan 30, 2023	D106332
H1419081	Certificate of Analysis	Jun 16, 2022	D106332

Chemical and Physical Properties

Solubility	Soluble in Methanol
Refractive Index	1.6
Flash Point(°F)	113 °C
Flash Point(°C)	113°C
Boil Point(°C)	335°C
Melt Point(°C)	45°C
Molecular Weight	210.270 g/mol
XLogP3	4.500
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	2
Exact Mass	210.104 Da
Monoisotopic Mass	210.104 Da
Topological Polar Surface Area	17.100 Å²
Heavy Atom Count	16
Formal Charge	0
Complexity	240.000
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
The total count of all stereochemical bonds	0
Covalently-Bonded Unit Count	1

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