CAS No.40771-26-4,1,2,3,4-TETRAHYDRO-1,5-NAPHTHALENEDIOL Suppliers,MSDS download

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Basic Information

CAS No.:

40771-26-4

Name:

1,2,3,4-TETRAHYDRO-1,5-NAPHTHALENEDIOL

Article Data:

Molecular Structure:

Formula:

C₁₀H₁₂O₂

Molecular Weight:

164.204

Synonyms:

1,5-Naphthalenediol,5,6,7,8-tetrahydro- (6CI);(RS)-1,5-Dihydroxytetralin;1,2,3,4-Tetrahydro-1,5-dihydroxynaphthalene;1,2,3,4-Tetrahydronaphthalene-1,5-diol;1,5-Dihydroxy-1,2,3,4-tetrahydronaphthalene;1,5-Dihydroxytetralin;5,6,7,8-Tetrahydro-1,5-dihydroxynaphthalene;NSC 96982;

EINECS:

255-070-7

Density:

1.246g/cm³

Melting Point:

132-134 °C(lit.)

Boiling Point:

325.9 °C at 760 mmHg

Flash Point:

162.4 °C

Hazard Symbols:

Risk Codes:

36/37/38

Safety:

Hazard Codes	Xi
Risk Statements	36/37/38
Safety Statements	26-37/39
WGK Germany	3

PSA:

40.46000

LogP:

1.76190

Country:
- China (Mainland)(33)
- United States(1)
Business Type:
All

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Specification

The 1,5-Dihydroxy-1,2,3,4-tetrahydronaphthalene with cas registry number of 40771-26-4, is also named 1,5-Naphthalenediol,5,6,7,8-tetrahydro- (6CI); (RS)-1,5-Dihydroxytetralin.

Physical properties of 1,5-Dihydroxy-1,2,3,4-tetrahydronaphthalene: (1)ACD/LogP: 1.32; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.32; (4)ACD/LogD (pH 7.4): 1.32; (5)ACD/BCF (pH 5.5): 5.9; (6)ACD/BCF (pH 7.4): 5.89; (7)ACD/KOC (pH 5.5): 123.97; (8)ACD/KOC (pH 7.4): 123.85; (9)#H bond acceptors: 2; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 18.46Å²; (13)Index of Refraction: 1.624; (14)Molar Refractivity: 46.51 cm³; (15)Molar Volume: 131.6 cm³; (16)Polarizability: 18.43×10^-24cm³; (17)Surface Tension: 52.9 dyne/cm; (18)Enthalpy of Vaporization: 59.97 kJ/mol; (19)Vapour Pressure: 9.08E-05 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following:
The 1,5-Dihydroxy-1,2,3,4-tetrahydronaphthalene to eyes, respiratory system and skin. When use it, wear suitable protective clothing, gloves and eye/face protection. If contact with eyes, rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure: (1)SMILES:Oc1cccc2c1CCCC2O; (2)InChI:InChI=1/C10H12O2/c11-9-5-1-3-7-8(9)4-2-6-10(7)12/h1,3,5,10-12H,2,4,6H2; (3)InChIKey:MYIDTCFDQGAVFL-UHFFFAOYAQ; (4)Std. InChI:InChI=1S/C10H12O2/c11-9-5-1-3-7-8(9)4-2-6-10(7)12/h1,3,5,10-12H,2,4,6H2; (5)Std. InChIKey:MYIDTCFDQGAVFL-UHFFFAOYSA-N.