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80-04-6

Basic Information
CAS No.: 80-04-6
Name: 4,4'-Isopropylidenedicyclohexanol
Article Data: 14
Molecular Structure:
Molecular Structure of 80-04-6 (4,4'-Isopropylidenedicyclohexanol)
Formula: C15H28O2
Molecular Weight: 240.386
Synonyms: Cyclohexanol,4,4'-isopropylidenedi- (6CI,7CI,8CI);1,1'-Isopropylidenebis[4-cyclohexanol];2,2-Bis(4-hydroxycyclohexyl)propane;Dodecahydrobisphenol A;HBPA;Hydrobisphenol A;Hydrogenated bisphenol A;NSC8990;NSC 8991;NSC 8992;Perhydrobisphenol A;Rikabinol HB;
EINECS: 201-244-2
Density: 1.048 g/cm3
Melting Point: 187 °C(Solv: benzene (71-43-2); ethanol (64-17-5))
Boiling Point: 341.2 °C at 760 mmHg
Flash Point: 151.7 °C
Solubility: Insoluble in water, soluble in benzene, acetone
Appearance: White flakes
Hazard Symbols: IrritantXi
Risk Codes: 36
Safety: 26
PSA: 40.46000
LogP: 3.11480
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    Chemical Name: 4,4'-Isopropylidenedicyclohexanol CAS No.: 80-04-6 Molecular Fomula: C15H28O2 Chemical Structure: Molecular weight: 240.38 Appearance: White solid Assay:95% Appearance:White powder Storage:Store in cool and dry place,

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    Product Name: 4,4'-Isopropylidenedicyclohexanol CAS: 80-04-6 MF: C15H28O2 MW: 240.38 EINECS: 201-244-2 Mol File: 80-04-6.mol 4,4'-Isopropylidenedicyclohexanol Structure 4,4'-Isopropylidenedicyclohexanol Chemical Proper

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    4,4'-Isopropylidenedicyclohexanol

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Specification

The IUPAC name of 2,2-Bis(4-hydroxycyclohexyl)propane is 4-[2-(4-hydroxycyclohexyl)propan-2-yl]cyclohexan-1-ol . With the CAS registry number 80-04-6, it is also named as 1,1'-Isopropylidenebis(4-cyclohexanol) ; 4,4'-Isopropylidenedicyclohexanol ; AI3-25180 ; Dodecahydrobisphenol A ; HBPA ; Hydrogenated bisphenol A ; NSC 8990 ; Cyclohexanol, 4,4'-(1-methylethylidene)bis- . The product's categories are medical intermediates, alcohols, monomers and polymer science.

The 2,2-Bis(4-hydroxycyclohexyl)propane is white flakes which is insoluble in water, and soluble in benzene and acetone . It has properties of thermal stability, light stability and chemical stability that can be used in the manufacture of epoxy resin, unsaturated polyester resin, polycarbonate resin, acrylic resin, etc. This product is irritating to eyes. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.

The other characteristics of this product can be summarized as: (1)ACD/LogP: 3.08 ; (2)# of Rule of 5 Violations: 0 ; (3)ACD/LogD (pH 5.5): 3.08 ; (4)ACD/LogD (pH 7.4): 3.08 ; (5)ACD/BCF (pH 5.5): 128.1 ; (6)ACD/BCF (pH 7.4): 128.1 ; (7)ACD/KOC (pH 5.5): 1122.51 ; (8)ACD/KOC (pH 7.4): 1122.51 ; (9)#H bond acceptors: 2 ; (10)#H bond donors: 2 ; (11)#Freely Rotating Bonds: 4 ; (12)Index of Refraction: 1.523 ; (13)Molar Refractivity: 70.08 cm3 ; (14)Molar Volume: 229.1 cm3 ; (15)Polarizability: 27.78×10-24 cm3 ; (16)Surface Tension: 45.1 dyne/cm ; (17)Enthalpy of Vaporization: 67.75 kJ/mol ; (18)Vapour Pressure: 5.36E-06 mmHg at 25°C ; (19)Rotatable Bond Count: 2 ; (20)Exact Mass: 240.20893 ; (21)MonoIsotopic Mass: 240.20893 ; (22)Topological Polar Surface Area: 40.5 ; (23)Heavy Atom Count: 17.

People can use the following data to convert to the molecule structure. SMILES: OC2CCC(C(C1CCC(O)CC1)(C)C)CC2; InChI: InChI=1/C15H28O2/c1-15(2,11-3-7-13(16)8-4-11)12-5-9-14(17)10-6-12/h11-14,16-17H,3-10H2,1-2H3. 2,2-Bis(4-hydroxycyclohexyl)propane has many suppliers, such as Changzhou Sunlight Pharmaceutical Co., Ltd..