Benzoic acid, p-(butylamino)-, 2-hydroxy-3-(phenylamino)propyl ester, hydrochloride

(3-anilino-2-hydroxypropyl) 4-(butylamino)benzoate chloride

CAS: 100311-25-9

Molecular Formula	`C20H26ClN2O3-`
Molecular Weight	377.9 g/mol
Topological Polar Surface Area	70.6 A2
Hydrogen Bond Donors	3
Hydrogen Bond Acceptors	6
Rotatable Bonds	11
Exact Mass	377.1632
Heavy Atoms	26
Complexity	364.0

Chemical Identifiers

CAS Number	100311-25-9
SMILES	`CCCCNC1=CC=C(C=C1)C(=O)OCC(CNC2=CC=CC=C2)O.[Cl-]`
InChIKey	`DBGHQQOLLYATEI-UHFFFAOYSA-M`

📖 Product Overview

Benzoic acid, p-(butylamino)-, 2-hydroxy-3-(phenylamino)propyl ester, hydrochloride (CAS: 100311-25-9) is a chemical compound with molecular formula C20H26ClN2O3- and molecular weight 377.9 g/mol. Its IUPAC systematic name is (3-anilino-2-hydroxypropyl) 4-(butylamino)benzoate chloride. Topological Polar Surface Area 70.6 A2 Hydrogen Bond Donors 3 Hydrogen Bond Acceptors 6 Rotatable Bonds 11 Exact Mass 377.1632 Heavy Atoms 26 Complexity 364.0 InChI Key: DBGHQQOLLYATEI-UHFFFAOYSA-M. SMILES: CCCCNC1=CC=C(C=C1)C(=O)OCC(CNC2=CC=CC=C2)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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