CAS No.2896-60-8,4-Ethylresorcinol Suppliers

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Basic Information

Molecular Structure:
CAS No.:	2896-60-8
Name:	4-Ethylresorcinol
Article Data:	23

Formula:	C₈H₁₀O₂
Molecular Weight:	138.166
Synonyms:	Resorcinol,4-ethyl- (6CI,7CI,8CI);1,3-Dihydroxy-4-ethylbenzene;4-Ethyl-1,3-benzenediol;6-Ethylresorcinol;NKO 11;NSC 62013;
EINECS:	220-777-1
Density:	1.159 g/cm³
Melting Point:	95-98 °C
Boiling Point:	273.8 °C at 760 mmHg
Flash Point:	134.4 °C
Appearance:	slightly beige crystalline powder
Hazard Symbols:	Xi
Risk Codes:	36/37/38
Safety:	26-37/39-36
PSA:	40.46000
LogP:	1.66020

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Specification

The 1,3-Benzenediol,4-ethyl-, with the CAS registry number 2896-60-8, is also known as 2,4-Dihydroxy-1-ethylbenzene. It belongs to the product category of Aromatic Phenols. Its EINECS registry number is 220-777-1. This chemical's molecular formula is C₈H₁₀O₂ and molecular weight is 138.1638. Its IUPAC name is called 4-ethylbenzene-1,3-diol. The product should be sealed and stored in cool, dry place.

Physical properties of 1,3-Benzenediol,4-ethyl-: (1)ACD/LogP: 1.75; (2)ACD/LogD (pH 5.5): 1.75; (3)ACD/LogD (pH 7.4): 1.75; (4)ACD/BCF (pH 5.5): 12.65; (5)ACD/BCF (pH 7.4): 12.59; (6)ACD/KOC (pH 5.5): 213.98; (7)ACD/KOC (pH 7.4): 213.09; (8)#H bond acceptors: 2; (9)#H bond donors: 2; (10)#Freely Rotating Bonds: 3; (11)Index of Refraction: 1.578; (12)Molar Refractivity: 39.56 cm³; (13)Molar Volume: 119.1 cm³; (14)Surface Tension: 48.2 dyne/cm; (15)Density: 1.159 g/cm³; (16)Flash Point: 134.4 °C; (17)Enthalpy of Vaporization: 53.27 kJ/mol; (18)Boiling Point: 273.8 °C at 760 mmHg; (19)Vapour Pressure: 0.00336 mmHg at 25°C.

Uses of 1,3-Benzenediol,4-ethyl-: it can be used to produce 4-ethyl-6-nitroso-benzene-1,3-diol at temperature of -5 - 5 °C. This reaction will need reagent aq. NaNO₂, HCl and solvent ethanol with reaction time of 15 min. The yield is about 82%.

When you are using this chemical, please be cautious about it as the following:
This chemical may cause inflammation to the skin or other mucous membranes. It is irritating to eyes, respiratory system and skin. In case of contact with eyes, you should rinse immediately with plenty of water and seek medical advice. Whenever you will contact it, please wear suitable protective clothing, gloves and eye/face protection.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: CCC1=C(C=C(C=C1)O)O
(2)InChI: InChI=1S/C8H10O2/c1-2-6-3-4-7(9)5-8(6)10/h3-5,9-10H,2H2,1H3
(3)InChIKey: VGMJYYDKPUPTID-UHFFFAOYSA-N