Methyl-p-benzoquinone, 99%

CAS
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CAS
553-97-9
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Catalog Number

ACM553979

Product Name

Methyl-p-benzoquinone, 99%

Structure

CAS

553-97-9

Category

Polymer/Macromolecule

Synonyms

EBD8348; SCHEMBL49207; 2-Methyl-1,4-benzochinon [Czech]; 2-Methylbenzoquinone-1,4; Toluchinon; NSC-405002; STK006340; AI3-14931; MCULE-9650878933; Toluquinone (VAN);

IUPAC Name

2-methylcyclohexa-2,5-diene-1,4-dione;

Molecular Weight

122.123g/mol

Molecular Formula

C7H6O2;

Canonical SMILES

CC1=CC(=O)C=CC1=O;

InChI

InChI=1S/C7H6O2/c1-5-4-6(8)2-3-7(5)9/h2-4H,1H3;

InChI Key

VTWDKFNVVLAELH-UHFFFAOYSA-N;

Melting Point

69.0°C;69 DEG C;

Density

1.08 @ 75.5 DEG C/4 DEG C;

Solubility

Slightly soluble in water; soluble in ethanol and ether;Very sol in acetone, ethyl acetate, alcohol, ether, and benzene; soluble in hot water;

Color/Form

YELLOW PLATES OR NEEDLES;YELLOW LEAFLETS OR NEEDLES;

Complexity

221

Covalently-Bonded Unit Count

EC Number

209-056-2

Exact Mass

122.037g/mol

H-Bond Acceptor

Heavy Atom Count

Monoisotopic Mass

122.037g/mol

NSC Number

405002

Octanol Water Partition Coefficient

0.72 (LogP);log Kow = 0.72;

Other Experimental

SUBLIMES;

RTECS Number

DK6300000

Topological Polar Surface Area

34.1A^2

UNII

VF06HB6AZN

MSDS

Download MSDS

COA

Download COA

Spec Sheet

Download Spec Sheet

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