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2H-1-Benzopyran-3-methanol,3,4-dihydro-

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Name

2H-1-Benzopyran-3-methanol,3,4-dihydro-

EINECS N/A
CAS No. 76727-28-1 Density 1.125 g/cm3
PSA 29.46000 LogP 1.23000
Solubility N/A Melting Point 61.5℃
Formula C10H12O2 Boiling Point 293.2 °C at 760 mmHg
Molecular Weight 164.2 Flash Point 133.9 °C
Transport Information N/A Appearance N/A
Safety 26-36/37/39 Risk Codes 36/37/38
Molecular Structure Molecular Structure of 76727-28-1 (3,4-DIHYDRO-2H-CHROMEN-3-YLMETHANOL) Hazard Symbols N/A
Synonyms

(Chroman-3-yl)methanol;3,4-Dihydro-2h-chromen-3-ylmethanol;

Article Data 8

2H-1-Benzopyran-3-methanol,3,4-dihydro- Specification

The CAS register number of 2H-1-Benzopyran-3-methanol,3,4-dihydro- is 76727-28-1. It also can be called as (Chroman-3-yl)methanol and the systematic name about this chemical is 3,4-dihydro-2H-chromen-3-ylmethanol. The molecular formula about this chemical is C10H12O2 and the molecular weight is 164.2.

Physical properties about 2H-1-Benzopyran-3-methanol,3,4-dihydro- are: (1)ACD/LogP: 1.99; (2)ACD/LogD (pH 5.5): 1.99; (3)ACD/LogD (pH 7.4): 1.99; (4)ACD/BCF (pH 5.5): 19.14; (5)ACD/BCF (pH 7.4): 19.14; (6)ACD/KOC (pH 5.5): 287.84; (7)ACD/KOC (pH 7.4): 287.84; (8)#H bond acceptors: 2; (9)#H bond donors: 1; (10)#Freely Rotating Bonds: 2; (11)Polar Surface Area: 18.46 Å2; (12)Index of Refraction: 1.546; (13)Molar Refractivity: 46.26 cm3; (14)Molar Volume: 145.8 cm3; (15)Polarizability: 18.33x10-24cm3; (16)Surface Tension: 45.6 dyne/cm; (17)Density: 1.125 g/cm3; (18)Flash Point: 133.9 °C; (19)Enthalpy of Vaporization: 56.27 kJ/mol; (20)Boiling Point: 293.2 °C at 760 mmHg; (21)Vapour Pressure: 0.000795 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. If you want to use it, wear suitable protective clothing, gloves and eye/face protection. In case of 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: OCC1Cc2c(OC1)cccc2
(2)InChI: InChI=1/C10H12O2/c11-6-8-5-9-3-1-2-4-10(9)12-7-8/h1-4,8,11H,5-7H2
(3)InChIKey: UPDSWAQIQZFOLF-UHFFFAOYAJ
(4)Std. InChI: InChI=1S/C10H12O2/c11-6-8-5-9-3-1-2-4-10(9)12-7-8/h1-4,8,11H,5-7H2
(5)Std. InChIKey: UPDSWAQIQZFOLF-UHFFFAOYSA-N

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