Benzenesulfonic acid,5-(acetylamino)-3-amino-2-methoxy- supplier

Name
5-acetamido-3-amino-2-methoxybenzenesulphonic acid
EINECS 275-001-4
CAS No. 70900-30-0
Density 1.516 g/cm³
Solubility
Melting Point
Formula C₉H₁₂N₂O₅S
Boiling Point
Molecular Weight 260.27
Flash Point
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 5-Acetamido-3-amino-2-methoxybenzenesulfonic acid;
PSA 130.59000
LogP 2.79400

Benzenesulfonic acid,5-(acetylamino)-3-amino-2-methoxy- Specification

The Benzenesulfonic acid, 5-(acetylamino)-3-amino-2-methoxy-, with the CAS registry number 70900-30-0, is also known as 1-Acetylamino-3-amino-4-methoxybenzene-5-sulfonic acid. And its EINECS registry number is 275-001-4. This chemical's molecular formula is C₉H₁₂N₂O₅S and molecular weight is 260.27. What's more, its IUPAC name is 5-Acetamido-3-amino-2-methoxybenzenesulfonic acid.

Physical properties about Benzenesulfonic acid, 5-(acetylamino)-3-amino-2-methoxy- are: (1)ACD/LogP: -2.04; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -5.49; (4)ACD/LogD (pH 7.4): -5.54; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 1; (8)ACD/KOC (pH 7.4): 1; (9)#H bond acceptors: 7; (10)#H bond donors: 4; (11)#Freely Rotating Bonds: 4; (12)Polar Surface Area: 84.53 Å²; (13)Index of Refraction: 1.617; (14)Molar Refractivity: 60.1 cm³; (15)Molar Volume: 171.5 cm³; (16)Polarizability: 23.82×10^-24 cm³; (17)Surface Tension: 71.3 dyne/cm; (18)Density: 1.516 g/cm³.

You can still convert the following datas into molecular structure:
(1) SMILES: O=S(=O)(O)c1cc(cc(N)c1OC)NC(=O)C
(2) InChI: InChI=1/C9H12N2O5S/c1-5(12)11-6-3-7(10)9(16-2)8(4-6)17(13,14)15/h3-4H,10H2,1-2H3,(H,11,12)(H,13,14,15)
(3) InChIKey: IGLOCMMNXMYDKL-UHFFFAOYAY

Product Name

5-acetamido-3-amino-2-methoxybenzenesulphonic acid

Benzenesulfonic acid,5-(acetylamino)-3-amino-2-methoxy- Specification

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