CAS No.6807-17-6,4,4'-(1,3-DIMETHYLBUTYLIDENE)DIPHENOL Suppliers

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Basic Information

Molecular Structure:
CAS No.:	6807-17-6
Name:	4,4'-(1,3-DIMETHYLBUTYLIDENE)DIPHENOL

Formula:	C₁₈H₂₂O₂
Molecular Weight:	270.371
Synonyms:	4,4'-(1,3-Dimethylbutylidene)diphenol;4-[2-(4-Hydroxyphenyl)-4-methyl-pentan-2-yl]phenol;AI3-50870;NSC73727;AC1Q1P3R;AC1Q7A5P;
EINECS:	401-720-1
Density:	1.083 g/cm³
Melting Point:	154 °C
Boiling Point:	430 °C at 760 mmHg
Flash Point:	198.7 °C
Hazard Symbols:	T.N
Risk Codes:	60-36-50/53
Safety:	53-45-60-61
PSA:	40.46000
LogP:	4.44990

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Specification

The Phenol, 4,4-(1,3-dimethylbutylidene)bis- with CAS registry number of 6807-17-6 is also known as 4,4'-(1,3-Dimethylbutylidene)diphenol. The IUPAC name is 4-[2-(4-Hydroxyphenyl)-4-methyl-pentan-2-yl]phenol. It belongs to product categories of Color Former & Related Compounds; Developer; Fluorenes, etc. (reagent for high-performance polymer research); Functional Materials; Reagent for High-Performance Polymer Research. Its EINECS registry number is 401-720-1. In addition, the formula is C₁₈H₂₂O₂ and the molecular weight is 270.37.

Physical properties about Phenol, 4,4-(1,3-dimethylbutylidene)bis- are: (1)ACD/LogP: 4.84; (2)ACD/LogD (pH 5.5): 4.84; (3)ACD/LogD (pH 7.4): 4.84; (4)ACD/BCF (pH 5.5): 2814.6; (5)ACD/BCF (pH 7.4): 2800.25; (6)ACD/KOC (pH 5.5): 10248.96; (7)ACD/KOC (pH 7.4): 10196.7; (8)#H bond acceptors: 2; (9)#H bond donors: 2; (10)#Freely Rotating Bonds: 6; (11)Index of Refraction: 1.571; (12)Molar Refractivity: 82.02 cm³; (13)Molar Volume: 249.4 cm³; (14)Surface Tension: 42.3 dyne/cm; (15)Density: 1.083 g/cm³; (16)Flash Point: 198.7 °C; (17)Enthalpy of Vaporization: 71.19 kJ/mol; (18)Boiling Point: 430 °C at 760 mmHg; (19)Vapour Pressure: 5.35E-08 mmHg at 25 °C.

Uses of Phenol, 4,4-(1,3-dimethylbutylidene)bis-: it is used to produce 2,2-bis[4-(1,1,2,2-tetrafluoroethoxy)phenyl]-4-methylpentane by addition with tetrafluoroethylene. The reaction occurs with reagent KOH and solvent dimethylsulfoxide at the temperature of 60 °C for 5 hours. The yield is about 95%.

Phenol, 4,4-(1,3-dimethylbutylidene)bis- is used to produce 2,2-bis[4-(1,1,2,2-tetrafluoroethoxy)phenyl]-4-methylpentane by addition with tetrafluoroethylene.

When you are using this chemical, please be cautious about it. As a chemical, it is irritating to eyes and very toxic to aquatic organisms that may cause long-term adverse effects in the aquatic environment. Besides, it may impair fertility. This material and its container must be disposed of as hazardous waste. During using it, avoid release to the environment and obtain special instructions. In case of accident or if you feel unwell seek medical advice immediately.

You can still convert the following datas into molecular structure:
1. Canonical SMILES: CC(C)CC(C)(C1=CC=C(C=C1)O)C2=CC=C(C=C2)O
2. InChI: InChI=1S/C18H22O2/c1-13(2)12-18(3,
14-4-8-16(19)9-5-14)15-6-10-17(20)11-7-15/h4-11,13,19-20H,12H2,1-3H3
3. InChIKey: VHLLJTHDWPAQEM-UHFFFAOYSA-N