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M-Cresol

CAT: 1459-CS-O-05550Size: 1 EachDry Ice: NoHazardous: No
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CAT#:1459-CS-O-05550Size:1 Each
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Description
M-Cresol is listed under Pesticide Standards and is intended for analytical research, quality control and pharmaceutical reference standard applications. It is associated with Amylmetacresol. The product is supplied by Clearsynth under CAT No. CS-O-05550. Clearsynth provides this compound for research and analytical use, with product information including CAS number, molecular formula, molecular weight and product enquiry details.
Overview
Impurity in commercial preparations of Policresulen
CAS Number
108-39-4
Synonyms
M-Cresol
Molecular Formula
C 7 H 8 O
Molecular Weight
108.14 g/mol
Additionnal Information
M-Cresol is supplied with detailed characterization data compliant with regulatory guideline. m-Cresol can be used for analytical method development, method validation (AMV), Quality Control (QC) application for Abbreviated New Drug Application (ANDA), or during commercial production of Amylmetacresol.
Storage Conditions
Refer MSDS for complete information.
Applications Notes
Impurity in commercial preparations of Policresulen
HSN Code
38229010
Hazard Compound
Refer MSDS for accurate information.

Chemical Information

M-Cresol

M-cresol is a cresol with the methyl substituent at position 3. It is a minor urinary metabolite of toluene. It has a role as a human xenobiotic metabolite.

CAS Number108-39-4
PubChem CID342
IUPAC Name3-methylphenol
Molecular FormulaC7H8O
Molecular Weight108.14
XLogP2
Topological Polar Surface Area20.2
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count0
Heavy Atom Count8
Formal Charge0
Complexity70
SMILES
CC1=CC(=CC=C1)O
InChI
InChI=1S/C7H8O/c1-6-3-2-4-7(8)5-6/h2-5,8H,1H3
InChIKey
RLSSMJSEOOYNOY-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of M-Cresol
CAS: 108-39-4
CID: 342
Formula: C7H8O
MW: 108.14
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight108.14
XLogP32
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count0
Exact Mass108.057514874
Monoisotopic Mass108.057514874
Topological Polar Surface Area20.2 Ų
Heavy Atom Count8
Formal Charge0
Complexity70.8
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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