1-BUTANOL, 2-(((3,4-DIMETHOXYPHENYL)METHYL)AMINO)-, HYDROCHLORIDE, (S)-

(3,4-dimethoxyphenyl)methyl-[(2R)-1-hydroxybutan-2-yl]azanium chloride

CAS: 112767-81-4

Molecular Formula	`C13H22ClNO3`
Molecular Weight	275.77 g/mol
Topological Polar Surface Area	55.3 A2
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	4
Rotatable Bonds	7
Exact Mass	275.1288
Heavy Atoms	18
Complexity	201.0

Chemical Identifiers

CAS Number	112767-81-4
SMILES	`CCC(CO)[NH2+]CC1=CC(=C(C=C1)OC)OC.[Cl-]`
InChIKey	`JUNPRUKHHLAGSQ-RFVHGSKJSA-N`

📖 Product Overview

1-BUTANOL, 2-(((3,4-DIMETHOXYPHENYL)METHYL)AMINO)-, HYDROCHLORIDE, (S)- (CAS: 112767-81-4) is a chemical compound with molecular formula C13H22ClNO3 and molecular weight 275.77 g/mol. Its IUPAC systematic name is (3,4-dimethoxyphenyl)methyl-[(2R)-1-hydroxybutan-2-yl]azanium chloride. Topological Polar Surface Area 55.3 A2 Hydrogen Bond Donors 2 Hydrogen Bond Acceptors 4 Rotatable Bonds 7 Exact Mass 275.1288 Heavy Atoms 18 Complexity 201.0 InChI Key: JUNPRUKHHLAGSQ-RFVHGSKJSA-N. SMILES: CCC(CO)[NH2+]CC1=CC(=C(C=C1)OC)OC.[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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What documentation do you provide with the product?

We provide COA (Certificate of Analysis), MSDS (Material Safety Data Sheet), and technical data sheets with each shipment.

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📚 Academic Support

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