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150975-95-4

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Basic Information
CAS No.: 150975-95-4
Name: 5-METHYLSULFONAMINOINDOLE-2-CARBOXYLIC ACID
Molecular Structure:
Molecular Structure of 150975-95-4 (5-METHYLSULFONAMINOINDOLE-2-CARBOXYLIC ACID)
Formula: C10H10N2O4S
Molecular Weight: 254.26
Synonyms: U 96364;
Density: 1.641 g/cm3
Boiling Point: 564.6 °C at 760 mmHg
Flash Point: 295.2 °C
PSA: 107.64000
LogP: 2.39140
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Specification

The 1H-Indole-2-carboxylicacid, 5-[(methylsulfonyl)amino]- is an organic compound with the formula C10H10N2O4S. The IUPAC name of this chemical is 5-(Methanesulfonamido)-1H-indole-2-carboxylic acid. With the CAS registry number 150975-95-4, it is also named as 5-Methylsulfonaminoindole-2-carboxylic acid. The product's category is Pharmacetical. Besides, its molecular weight is 254.26.

Physical properties about 1H-Indole-2-carboxylicacid, 5-[(methylsulfonyl)amino]- are: (1)ACD/LogP: 1.04; (2)ACD/LogD (pH 5.5): -0.38; (3)ACD/LogD (pH 7.4): -1.88; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 3.34; (7)ACD/KOC (pH 7.4): 1; (8)#H bond acceptors: 6; (9)#H bond donors: 3; (10)#Freely Rotating Bonds: 2; (11)Polar Surface Area: 76.99 Å2; (12)Index of Refraction: 1.726; (13)Molar Refractivity: 61.6 cm3; (14)Molar Volume: 154.8 cm3; (15)Polarizability: 24.42×10-24 cm3; (16)Surface Tension: 88.3 dyne/cm; (17)Density: 1.641 g/cm3; (18)Flash Point: 295.2 °C; (19)Enthalpy of Vaporization: 89.24 kJ/mol; (20)Boiling Point: 564.6 °C at 760 mmHg; (21)Vapour Pressure: 1.39E-13 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1)InChI: InChI=1/C10H10N2O4S/c1-17(15,16)12-7-2-3-8-6(4-7)5-9(11-8)10(13)14/h2-5,11-12H,1H3,(H,13,14)
(2)InChIKey: AHXMYKDPQPQFMW-UHFFFAOYAX
(3)Std. InChI: InChI=1S/C10H10N2O4S/c1-17(15,16)12-7-2-3-8-6(4-7)5-9(11-8)10(13)14/h2-5,11-12H,1H3,(H,13,14)
(4)Std. InChIKey: AHXMYKDPQPQFMW-UHFFFAOYSA-N