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1-Propanol, 2-methyl-2-(propylamino)-, 1-benzoate, hydrochloride (1:1)

HCID 101925
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Basic informationOverviewNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
956-03-6
Standard SMILES
CCCNC(C)(C)COC(=O)c1ccccc1.Cl
InChIKey
LKHWKAGQNOMUFQ-UHFFFAOYSA-N
Molecular formula
C14H22ClNO2
Average molar mass
271.78 g/mol
Monoisotopic mass
271.1339066

Overview

Meprylcaine hydrochloride is a benzoate ester.

Names & identifiers

Preferred name
1-Propanol, 2-methyl-2-(propylamino)-, 1-benzoate, hydrochloride (1:1)
IUPAC
[2-methyl-2-(propylamino)propyl] benzoate;hydrochloride
English name
MEPRYLCAINE HYDROCHLORIDE (200 MG)
Molecular formula
C14H22ClNO2
Molecular weight
271.78298

Names & synonyms

1-Propanol, 2-methyl-2-(propylamino)-, 1-benzoate, hydrochloride (1:1)RefChem:436244Meprylcaine hydrochloride956-03-6Meprylcaine HClDTXSID4045341NSC-7600712-Methyl-2-(propylamino)-1-propanol benzoate (ester) hydrochlorideVR843X5GXG[2-methyl-2-(propylamino)propyl] benzoate;hydrochlorideOracaine hydrochloride1-Propanol-2-methyl-2-(propylamino)-, benzoate (ester), hydrochloride
Show more names
meprylcainehydrochlorideLKHWKAGQNOMUFQ-UHFFFAOYSA-Nmeprylcaine monohydrochlorideMEPRYLCAINE HYDROCHLORIDE (200 MG)Meprylcaine Hydrochloride (1390007)[2-methyl-2-(propylamino)propyl] benzoate hydrochloride2-(Benzoyloxy)methyl-2-propylaminopropane·hydrochloride2-methyl-2-(propylamino)-1-propanolbenzoatehydrochloride[2-(benzoyloxy)-1,1-dimethylethyl]propylammonium chloridebenzoic acid [2-methyl-2-(propylamino)propyl] ester hydrochloride

Properties

Computed structural properties

Topological polar surface area
38.3 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
3
Rotatable bonds
7
Heavy atoms
18
Formal charge
0
Complexity
232

Physicochemical properties

Melting point
150 · 150-151°
solubility
DMSO (Sparingly), Methanol (Slightly)
form
Solid
color
2 · Crystals from 2-propanol
FDA UNII
843 X5GXG · VR843X5GXG
EPA Substance Registry System
Meprylcaine hydrochloride (956-03-6)
TSCA
TSCA listed
Toxicity
50 ipr-mus: · LD50 ipr-mus: 225 mg/kg AIPTAK115,483,58

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

Safety data

tsca
TSCA listed
Toxicity
LD50 ipr-mus: 225 mg/kg AIPTAK115,483,58

Chemistry & industry

Uses & manufacturing

General Manufacturing Information1-Propanol, 2-methyl-2-(propylamino)-, 1-benzoate, hydrochloride (1:1): INACTIVE

Applications

UsesMeprylcaine Hydrochloride is a local anaesthetic used in medical procedures.

Upstream & downstream products

Upstream raw materials

Benzoyl chloride

Additional notes

DefinitionChEBI: Meprylcaine hydrochloride is a benzoate ester.

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Related reactions

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Compound notes

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On this pageBasic informationOverviewNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
DTXCID2025341Meprylcaine hydrochloride (JAN)MEPRYLCAINE HYDROCHLORIDE [JAN]2-methyl-2-(propylamino)propyl benzoate, chlorideNCGC00016551-01CAS-956-03-6EINECS 213-475-6UNII-VR843X5GXG

Database identifiers

CAS
956-03-6
PubChem CID
101925
DTXSID
DTXSID4045341
ChEMBL
CHEMBL2104800
ChEBI
CHEBI:31820
UNII
VR843X5GXG
EC Number
213-475-6