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Benzenemethanesulfonicacid, a-hydroxy-4-methoxy-

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Benzenemethanesulfonicacid, a-hydroxy-4-methoxy-

EINECS 201-326-8
CAS No. 81-12-9 Density 1.489 g/cm3
PSA 92.21000 LogP 1.65470
Solubility N/A Melting Point N/A
Formula C8H10O5S Boiling Point N/A
Molecular Weight 218.227 Flash Point N/A
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 81-12-9 (alpha-hydroxy-p-methoxytoluene-alpha-sulphonic acid) Hazard Symbols N/A

a-Toluenesulfonic acid, a-hydroxy-p-methoxy- (8CI);p-Methoxybenzaldehyde bisulfite;α-Hydroxy-4-methoxybenzenemethanesulfonic acid;alpha-hydroxy-p-methoxytoluene-alpha-sulphonic acid;


Benzenemethanesulfonicacid, a-hydroxy-4-methoxy- Specification

The CAS register number of Benzenemethanesulfonicacid, a-hydroxy-4-methoxy- is 81-12-9. It also can be called as α-Hydroxy-4-methoxybenzenemethanesulfonic acid and the IUPAC name about this chemical is hydroxy-(4-methoxyphenyl)methanesulfonic acid. The molecular formula about this chemical is C8H10O5S and the molecular weight is 218.227.

Physical properties about Benzenemethanesulfonicacid, a-hydroxy-4-methoxy- are: (1)ACD/LogP: -0.82; (2)ACD/LogD (pH 5.5): -4.29; (3)ACD/LogD (pH 7.4): -4.32; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 1; (7)ACD/KOC (pH 7.4): 1; (8)#H bond acceptors: 5; (9)#H bond donors: 2; (10)#Freely Rotating Bonds: 4; (11)Polar Surface Area: 70.21 Å2; (12)Index of Refraction: 1.592; (13)Molar Refractivity: 49.61 cm3; (14)Molar Volume: 146.5 cm3; (15)Polarizability: 19.66x10-24cm3; (16)Surface Tension: 64.9 dyne/cm; (17)Density: 1.489 g/cm3.

You can still convert the following datas into molecular structure:
(1)SMILES: O=S(=O)(O)C(O)c1ccc(OC)cc1
(2)InChI: InChI=1/C8H10O5S/c1-13-7-4-2-6(3-5-7)8(9)14(10,11)12/h2-5,8-9H,1H3,(H,10,11,12)
(4)Std. InChI: InChI=1S/C8H10O5S/c1-13-7-4-2-6(3-5-7)8(9)14(10,11)12/h2-5,8-9H,1H3,(H,10,11,12)

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