2-Methoxy-4-methylphenol(CAS No. 93-51-6)

Directory: 1. Identification and Related Records; 2. Chemical and Physical Properties; 3. Safety and Handling; 4. Use and Manufacturing

2-Methoxy-4-methylphenol C8H10O2 (cas 93-51-6) Molecular Structure

93-51-6 Structure

Identification and Related Records

【Name】: 2-Methoxy-4-methylphenol

【Registry number】: 93-51-6 (CAS DataBase Reference)

【Synonyms】: Creosol(6CI)
p-Cresol, 2-methoxy- (8CI)
2-Methoxy-4-methylphenol
2-Methoxy-p-cresol
3-Methoxy-4-hydroxytoluene
4-Hydroxy-3-methoxy-1-methylbenzene
4-Hydroxy-3-methoxytoluene
4-Methyl-2-methoxyphenol
4-Methylguaiacol
Homoguaiacol
NSC 4969
p-Creosol
p-Methylguaiacol

【EINECS(EC#)】: 202-252-9

【Molecular Formula】: C8H10O2 (Products with the same molecular formula)

【Molecular Weight】: 138.16

【Inchi】: InChI=1/C8H10O2/c1-6-3-4-7(9)8(5-6)10-2/h3-5,9H,1-2H3

【InChIKey】: PETRWTHZSKVLRE-UHFFFAOYSA-N

【MOL File】
93-51-6.mol

Chemical and Physical Properties

【Appearance】: clear liquid

【Density】: 1.092

【Melting Point】: 2℃

【Boiling Point】: 221-222ºC

【Refractive Index】: 1.536-1.538

【Flash Point】: 211 ºF

【Solubilities】: Slightly soluble

【Stability】: Stable at room temperature in closed containers under normal storage and handling conditions.

【HS Code】: 29095090

【Storage temp】: Keep away from heat, sparks, and flame. Store in a tightly closed container. Store in a cool, dry, well-ventilated area away from incompatible substances.

【Computed Properties】: Molecular Weight:138.1638 [g/mol]
Molecular Formula:C₈H₁₀O₂
XLogP3:1.3
H-Bond Donor:1
H-Bond Acceptor:2
Rotatable Bond Count:1
Tautomer Count:3
Exact Mass:138.06808
MonoIsotopic Mass:138.06808
Topological Polar Surface Area:29.5
Heavy Atom Count:10
Formal Charge:0
Complexity:103
Isotope Atom Count:0
Defined Atom Stereocenter Count:0
Undefined Atom Stereocenter Count:0
Defined Bond Stereocenter Count:0
Undefined Bond Stereocenter Count:0
Covalently-Bonded Unit Count:1
Feature 3D Acceptor Count:1
Feature 3D Donor Count:1
Feature 3D Ring Count:1
Effective Rotor Count:1
Conformer Sampling RMSD:0.4
CID Conformer Count:3

Safety and Handling

【Hazard Codes】: Xi:Irritant;

【Risk Statements】: R36/37/38

【Safety Statements 】: S24/25

【HazardClass】: 6.1(a)

【PackingGroup 】: II

【Transport】: OTH

Use and Manufacturing

【Usage】: Reacts with hydrogen halide to give a catechol. .

Supplier Location

Top Suppliers

AOPHARM: Country:China; Business Type:Manufacturer; Telephone:86-311-66600578; WebSite:www.aopharm.com

Hangzhou Dayangchem Co., Ltd.: Country:China; Business Type:Manufacturer; Telephone:86-571-88938639; WebSite:www.chinadayangchem.com/

Dalian Aoya Import and Export Co.,Ltd: Country:China; Business Type:Manufacturer; Telephone:86-411-39837611; WebSite:www.cn-aoya.com

Amadis Chemical Co.,Ltd.: Country:China; Business Type:Manufacturer; Telephone:86-571-89925085; WebSite:www.amadischem.com

Intatrade Chemicals GmbH: Country:Germany; Business Type:Trading Company; Telephone:49-3493-605464; WebSite:www.intatrade.de

Shanghai P&T Fine Chemical Co., Ltd.: Country:China; Business Type:Manufacturer; Telephone:86-21-12345678; WebSite:www.pt-pharm.com/

Shijiazhuang Sdyano Fine Chemical Co., Ltd: Country:China; Business Type:Manufacturer; Telephone:86-311-89830448; WebSite:www.sjzsdyn.com/en/

ZIBO SVOLEI FRAGRANCE CO.,LTD: Country:China; Business Type:Manufacturer; Telephone:86-533-7220061; WebSite:www.svolei.com

NEOCHEMICALS: Country:Singapore; Business Type:Manufacturer; Telephone:65-356-5246541

Zouping Mingxing Chemical Co.,Ltd.: Country:China; Business Type:Manufacturer; Telephone:86-135-15431451; WebSite:www.zoutong.com.cn

Raw materials

4-Methylcatechol

Preparation Products

Pyrocatechol

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