CAS No.72041-59-9,4-TETRAHYDROPYRANOXY-2-HYDROXYBENZALDEHYDE Suppliers

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Basic Information

Molecular Structure:
CAS No.:	72041-59-9
Name:	4-TETRAHYDROPYRANOXY-2-HYDROXYBENZALDEHYDE
Article Data:	15

Formula:	C₁₂H₁₄O₄
Molecular Weight:	222.241
Synonyms:	4-[(2-Tetrahydropyranyl)oxy]-2-hydroxybenzaldehyde;
Density:	1.255 g/cm³
Boiling Point:	382.2 °C at 760 mmHg
Flash Point:	148.6 °C
Risk Codes:	36/37/38
Safety:	26-36/37/39
PSA:	55.76000
LogP:	2.11010

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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