[3-[4-(butylamino)benzoyl]oxy-2-hydroxypropyl]azanium chloride

CAS: 100311-21-5

Molecular Formula	`C14H23ClN2O3`
Molecular Weight	302.8 g/mol
Topological Polar Surface Area	86.2 A2
Hydrogen Bond Donors	3
Hydrogen Bond Acceptors	5
Rotatable Bonds	9
Exact Mass	302.1397
Heavy Atoms	20
Complexity	253.0

Chemical Identifiers

CAS Number	100311-21-5
SMILES	`CCCCNC1=CC=C(C=C1)C(=O)OCC(C[NH3+])O.[Cl-]`
InChIKey	`YXTIJVKBDFBNIG-UHFFFAOYSA-N`

📖 Product Overview

[3-[4-(butylamino)benzoyl]oxy-2-hydroxypropyl]azanium chloride (CAS: 100311-21-5) is a chemical compound with molecular formula C14H23ClN2O3 and molecular weight 302.8 g/mol. Its IUPAC systematic name is [3-[4-(butylamino)benzoyl]oxy-2-hydroxypropyl]azanium chloride. Topological Polar Surface Area 86.2 A2 Hydrogen Bond Donors 3 Hydrogen Bond Acceptors 5 Rotatable Bonds 9 Exact Mass 302.1397 Heavy Atoms 20 Complexity 253.0 InChI Key: YXTIJVKBDFBNIG-UHFFFAOYSA-N. SMILES: CCCCNC1=CC=C(C=C1)C(=O)OCC(C[NH3+])O.[Cl-].

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.

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