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70969-66-3

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Basic Information
CAS No.: 70969-66-3
Name: 3,4,5-TRIMETHYLPHENOL
Molecular Structure:
Molecular Structure of 70969-66-3 (3,4,5-TRIMETHYLPHENOL)
Formula: C9H12O
Molecular Weight: 136.19
Synonyms: 2,3,5-Trimethylbenzolol;1-Hydroxy-2,3,5-trimethylbenzene;
EINECS: 211-806-9
Density: 0.996 g/cm3
Melting Point: 92-95℃
Boiling Point: 231.1 °C at 760 mmHg
Flash Point: 103.6 °C
Solubility: insoluble
Hazard Symbols: R36/37/38:;
Risk Codes:  Xi:Irritant;
">  Xi:Irritant;
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  • Phenol, 2,3,5(or 3,4,5)-trimethyl-

  • Casno:

    70969-66-3

    Phenol, 2,3,5(or 3,4,5)-trimethyl-

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    We are a Union of chemistry in China, consists of chemists,engineers, laboratories,factories in China. We organize surplus capacity of R&D and production as well as custom synthesis for chemical products and chemical business project. We are supp

    We are a Union of chemistry in China, consists of chemists,engineers, laboratories,factories in China. We organize surplus capacity of R&D and production in China for chemicals cus

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  • Phenol, 2,3,5(or 3,4,5)-trimethyl-

  • Casno:

    70969-66-3

    Phenol, 2,3,5(or 3,4,5)-trimethyl-

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    Our own factory produces direct sales with absolute price advantage Application:Pharmaceutical industry Transportation:By sea Port:Shanghai/tianjin

    Antimex Chemical Limied, was founded in 2001, we are specializing in manufacturing & researching of Active pharmaceutical Ingredients,Veterinary pharm APIs,cosmetic ingredients,and

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  • 3,4,5-TRIMETHYLPHENOL

  • Casno:

    70969-66-3

    3,4,5-TRIMETHYLPHENOL

    Min.Order: 0

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    factory?direct?saleAppearance:White powder Storage:Sealed and preserved Package:200/Kilograms Application:healing drugs Transportation:By sea Port:Shanghai/tianjin

    Zhejiang Jiuzhou Chemical Co.,Ltd is a market-oriented and innovation-driven biopharmaceutical company. The company is focusing on the R&D, manufacturing and sales of pharmaceutica

  •  ZHEJIANG JIUZHOU CHEM CO.,LTD

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    Tel:+86 19334956669

    Address:Waisha Road,Jiaojiang

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Specification

The Phenol, 2,3,5(or 3,4,5)-trimethyl-, with the CAS registry number 70969-66-3, is also known as 1-Hydroxy-2,3,5-trimethylbenzene. This chemical's molecular formula is C9H12O and molecular weight is 136.19. What's more, its systematic name is 2,3,5-trimethylphenol. 

Physical properties of Phenol, 2,3,5(or 3,4,5)-trimethyl- are: (1)ACD/LogP: 2.86; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.86; (4)ACD/LogD (pH 7.4): 2.86; (5)ACD/BCF (pH 5.5): 88.16; (6)ACD/BCF (pH 7.4): 88.09; (7)ACD/KOC (pH 5.5): 859.07; (8)ACD/KOC (pH 7.4): 858.45; (9)#H bond acceptors: 1; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 9.23 Å2; (13)Index of Refraction: 1.535; (14)Molar Refractivity: 42.6 cm3; (15)Molar Volume: 136.6 cm3; (16)Polarizability: 16.89×10-24cm3; (17)Surface Tension: 36.1 dyne/cm; (18)Density: 0.996 g/cm3; (19)Flash Point: 103.6 °C; (20)Enthalpy of Vaporization: 48.67 kJ/mol; (21)Boiling Point: 231.1 °C at 760 mmHg; (22)Vapour Pressure: 0.0419 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: CC1=CC(=C(C(=C1)O)C)C
(2)InChI: InChI=1S/C9H12O/c1-6-4-7(2)8(3)9(10)5-6/h4-5,10H,1-3H3
(3)InChIKey: OGRAOKJKVGDSFR-UHFFFAOYSA-N