Nahapba structure

Nahapba

[4-(6-aminohexylcarbamoyl)-3-nitrophenyl]boronic acid

Also Known As: Nahapba|3-nitro-4- phenylboronicacid|KST-1B8881|3-Nitro-4-(6-aminohexylamido)phenylboronic acid|[4-(6-aminohexylcarbamoyl)-3-nitrophenyl]boronic acid|(4-(((6-Aminohexyl)amino)carbonyl)-3-nitrophenyl)boronic acid|{4-[(6-aminohexyl)carbamoyl]-3-nitrophenyl}boronic acid|(4-((6-aminohexyl)carbamoyl)-3-nitrophenyl)boronic acid|Boronic acid, (4-(((6-aminohexyl)amino)carbonyl)-3-nitrophenyl)-|N-(6-Aminohexyl)-4-borono-2-nitrobenzene-1-carboximidic acid

CAS: 84953-74-2
Molecular Formula C13H20BN3O5
Molecular Weight 309.1496 g/mol
LogP -0.4765
Topological Polar Surface Area 141.0 Ų
Hydrogen Bond Donors 4
Hydrogen Bond Acceptors 6
Rotatable Bonds 8
Exact Mass 309.1496
Monoisotopic Mass 309.1496
Heavy Atoms 22
Complexity 364.0

Chemical Identifiers

CAS Number 84953-74-2
SMILES B(C1=CC(=C(C=C1)C(=O)NCCCCCCN)[N+](=O)[O-])(O)O
InChIKey VDHUVZLEHHHMRS-UHFFFAOYSA-N

Product Overview

Nahapba (CAS 84953-74-2), with molecular formula C13H20BN3O5 and molecular weight 309.1496 g/mol. IUPAC: [4-(6-aminohexylcarbamoyl)-3-nitrophenyl]boronic acid.

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