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N-(2,1,3-Benzothiadiazol-4-ylsulfonyl)-β-alanine

N-(2,1,3-Benzothiadiazol-4-ylsulfonyl)-β-alanine structure

CAS No:
405279-59-6
Formula:
C9H9N3O4S2
Chemical Name:
N-(2,1,3-Benzothiadiazol-4-ylsulfonyl)-β-alanine
Synonyms:
β-Alanine,N-(2,1,3-benzothiadiazol-4-ylsulfonyl)-;N-(2,1,3-Benzothiadiazol-4-ylsulfonyl)-β-alanine

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N-(2,1,3-Benzothiadiazol-4-ylsulfonyl)-β-alanine Basic Attributes

Molecular Weight：

287.32

Exact Mass：

287.32

Characteristics

PSA：

146

XLogP3：

0.3

Melting Point：

176.1-176.3 °C @ Solvent: Dichloromethane, Hexane

Safety Information

Hazard category：

IRRITANT

Marks：

Computed Properties

Molecular Weight:287.3
XLogP3:0.3
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:5
Exact Mass:287.00344812
Monoisotopic Mass:287.00344812
Topological Polar Surface Area:146
Heavy Atom Count:18
Complexity:409
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of N-(2,1,3-Benzothiadiazol-4-ylsulfonyl)-β-alanine

Basic Attributes
Characteristics
Safety Information
Computed Properties

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