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Benzaldehyde,2-hydroxy-4-[(tetrahydro-2H-pyran-2-yl)oxy]-

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Name

Benzaldehyde,2-hydroxy-4-[(tetrahydro-2H-pyran-2-yl)oxy]-

EINECS N/A
CAS No. 72041-59-9 Density 1.255 g/cm3
PSA 55.76000 LogP 2.11010
Solubility N/A Melting Point N/A
Formula C12H14O4 Boiling Point 382.2 °C at 760 mmHg
Molecular Weight 222.241 Flash Point 148.6 °C
Transport Information N/A Appearance N/A
Safety 26-36/37/39 Risk Codes 36/37/38
Molecular Structure Molecular Structure of 72041-59-9 (4-TETRAHYDROPYRANOXY-2-HYDROXYBENZALDEHYDE) Hazard Symbols N/A
Synonyms

4-[(2-Tetrahydropyranyl)oxy]-2-hydroxybenzaldehyde;

Article Data 15

Benzaldehyde,2-hydroxy-4-[(tetrahydro-2H-pyran-2-yl)oxy]- Specification

This chemical is called Benzaldehyde,2-hydroxy-4-[(tetrahydro-2H-pyran-2-yl)oxy]-, and its systematic name is 2-hydroxy-4-(tetrahydro-2H-pyran-2-yloxy)benzaldehyde. With the molecular formula of C12H14O4, its molecular weight is 222.24. The CAS registry number of this chemical is 72041-59-9. Additionally, its product categories are Pharmacetical.

Other characteristics of the Benzaldehyde,2-hydroxy-4-[(tetrahydro-2H-pyran-2-yl)oxy]- can be summarised as followings: (1)ACD/LogP: 1.78; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.78; (4)ACD/LogD (pH 7.4): 1.59; (5)ACD/BCF (pH 5.5): 13.22; (6)ACD/BCF (pH 7.4): 8.52; (7)ACD/KOC (pH 5.5): 220.43; (8)ACD/KOC (pH 7.4): 142.12; (9)#H bond acceptors: 4; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 4; (12)Polar Surface Area: 44.76 Å2; (13)Index of Refraction: 1.588; (14)Molar Refractivity: 59.59 cm3; (15)Molar Volume: 177 cm3; (16)Polarizability: 23.62×10-24cm3; (17)Surface Tension: 52.2 dyne/cm; (18)Density: 1.255 g/cm3; (19)Flash Point: 148.6 °C; (20)Enthalpy of Vaporization: 65.52 kJ/mol; (21)Boiling Point: 382.2 °C at 760 mmHg; (22)Vapour Pressure: 2.19E-06 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following: This chemical is irritating to eyes, respiratory system and skin. You should wear suitable protective clothing when you use it. In case of contacting with eyes, rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure: 
1.SMILES: O=Cc2ccc(OC1OCCCC1)cc2O
2.InChI: InChI=1/C12H14O4/c13-8-9-4-5-10(7-11(9)14)16-12-3-1-2-6-15-12/h4-5,7-8,12,14H,1-3,6H2
3.InChIKey: NDAHKJIBTIDZIO-UHFFFAOYAV

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