2-(Benzylsulfonylamino)-3-methylpentanoic acid

HCID 344432
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Basic information

Standard SMILES
CCC(C)C(NS(=O)(=O)Cc1ccccc1)C(=O)O
InChIKey
BONOQNDSZHYLAR-UHFFFAOYSA-N
Molecular formula
C13H19NO4S
Average molar mass
285.36 g/mol
Monoisotopic mass
285.10347926

Names & identifiers

Preferred name
2-(Benzylsulfonylamino)-3-methylpentanoic acid
IUPAC
2-(benzylsulfonylamino)-3-methylpentanoic acid

Names & synonyms

NSC401330AKOS000128468AKOS017273897NSC-401330

Database identifiers

PubChem CID
344432

Properties

Computed structural properties

XLogP
2.1
Topological polar surface area
91.9 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
5
Rotatable bonds
7
Heavy atoms
19

Related reactions

2 records
New reaction record

Compound notes

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