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N-(3-Carboxy-4-hydroxyphenyl)-β-D-glucopyranosylamine

N-(3-Carboxy-4-hydroxyphenyl)-β-D-glucopyranosylamine structure

CAS No:
123135-21-7
Formula:
C13H17NO8
Chemical Name:
N-(3-Carboxy-4-hydroxyphenyl)-β-D-glucopyranosylamine

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N-(3-Carboxy-4-hydroxyphenyl)-β-D-glucopyranosylamine Basic Attributes

Molecular Weight：

315.27600

Exact Mass：

315.09541650 g/mol

Characteristics

PSA：

159.71000

XLogP3：

-1.62480

Density：

1.723g/cm3

Boiling Point：

671.1ºC at 760mmHg

Flash Point：

359.6ºC

Refractive Index：

1.739

Vapor Pressure：

6.36E-19mmHg at 25°C

Drug Information

MeSH Entry Terms：

N-glucopyranosyl-5-aminosalicylic acid

Computed Properties

Molecular Weight:315.28
XLogP3:-0.5
Hydrogen Bond Donor Count:7
Hydrogen Bond Acceptor Count:9
Rotatable Bond Count:4
Exact Mass:315.09541650
Monoisotopic Mass:315.09541650
Topological Polar Surface Area:160
Heavy Atom Count:22
Complexity:394
Defined Atom Stereocenter Count:5
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of N-(3-Carboxy-4-hydroxyphenyl)-β-D-glucopyranosylamine

Basic Attributes
Characteristics
Drug Information
Computed Properties

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