Cas no 854184-18-2 (1-(3-Methoxyphenyl)ethylamine hydrochloride)

1-(3-Methoxyphenyl)ethylamine hydrochloride structure
854184-18-2 structure
Product Name:1-(3-Methoxyphenyl)ethylamine hydrochloride
CAS No:854184-18-2
MF:C9H14ClNO
MW:187.666561603546
MDL:MFCD12198854
CID:1003175
Update Time:2024-12-09

1-(3-Methoxyphenyl)ethylamine hydrochloride Chemical and Physical Properties

Names and Identifiers

    • 1-(3-Methoxyphenyl)ethanamine hydrochloride
    • 1-(3-Methoxyphenyl)ethylaMine Hydrochloride
    • 1-(3-Methoxyphenyl)ethylamine HCl
    • AK175400
    • 1-(3-Methoxyphenyl)ethylamine, HCl
    • TRA0088475
    • SY005334
    • 1-(3-Methoxyphenyl)ethylamineHydrochloride
    • V8096
    • (1S)-1-(3-methoxyphenyl)ethanamine;hydrochloride
    • (1R)-1-(3-methoxyphenyl)ethanamine;hydrochloride
    • Benzylamine, m-methoxy-α-methyl-, hydrochloride (5CI)
    • 1-(3-Methoxyphenyl)ethylamine hydrochloride
    • MDL: MFCD12198854
    • Inchi: 1S/C9H13NO.ClH/c1-7(10)8-4-3-5-9(6-8)11-2;/h3-7H,10H2,1-2H3;1H
    • InChI Key: IPMGDPJDHDVXRQ-UHFFFAOYSA-N
    • SMILES: Cl.O(C)C1C=C(C(C)N)C=CC=1

Computed Properties

  • Exact Mass: 187.07600
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 2
  • Complexity: 116
  • Topological Polar Surface Area: 35.2

Experimental Properties

  • PSA: 35.25000
  • LogP: 3.21720

1-(3-Methoxyphenyl)ethylamine hydrochloride Customs Data

  • HS CODE:2922299090
  • Customs Data:

    China Customs Code:

    2922299090

    Overview:

    2922299090. Other amino groups(naphthol\phenol)And ether\Esters [including their salts, Except those containing more than one oxygen-containing group]. VAT:17.0%. Tax refund rate:13.0%. Regulatory conditions:nothing. MFN tariff:6.5%. general tariff:30.0%

    Declaration elements:

    Product Name, component content, use to, The color of ethanolamine and its salt should be reported, The package of ethanolamine and its salt shall be declared

    Summary:

    2922299090. other amino-naphthols and other amino-phenols, other than those containing more than one kind of oxygen function, their ethers and esters; salts thereof. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0%

1-(3-Methoxyphenyl)ethylamine hydrochloride Pricemore >>

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1-(3-Methoxyphenyl)ethylamine hydrochloride Production Method

Production Method 1

Reaction Conditions
1.1 Catalysts: Triphos ,  Borate(1-), tetrafluoro-, cobalt(2+) (2:1) Solvents: 2,2,2-Trifluoroethanol ;  15 min, rt
1.2 Reagents: Hydrogen ,  Ammonia ;  24 h, 40 bar, 120 °C
1.3 Reagents: Hydrochloric acid Solvents: Methanol ;  4 - 5 h, rt
Reference
Homogeneous cobalt-catalyzed reductive amination for synthesis of functionalized primary amines
Murugesan, Kathiravan; et al, Nature Communications, 2019, 10(1), 1-9

Production Method 2

Reaction Conditions
1.1 Catalysts: Nickel tetrafluoroborate ,  Triphos Solvents: 2,2,2-Trifluoroethanol ;  15 min, rt
1.2 Reagents: Hydrogen ,  Ammonia ;  24 h, 50 bar, 120 °C; 120 °C → rt
1.3 Reagents: Hydrochloric acid Solvents: Diethyl ether ,  Methanol ;  4 - 5 h, rt
Reference
General and selective synthesis of primary amines using Ni-based homogeneous catalysts
Murugesan, Kathiravan; et al, Chemical Science, 2020, 11(17), 4332-4339

Production Method 3

Reaction Conditions
1.1 Reagents: 3,5-Bis(1,1-dimethylethyl) 1,4-dihydro-2,6-dimethyl-3,5-pyridinedicarboxylate Catalysts: 2482544-45-4 Solvents: Methylcyclohexane ,  tert-Butyl methyl ether ;  rt
Reference
Chiral Bronsted Acids Catalyze Asymmetric Additions to Substrates that Are Already Protonated: Highly Enantioselective Disulfonimide-Catalyzed Hantzsch Ester Reductions of NH-Imine Hydrochloride Salts
Wakchaure, Vijay N.; et al, Synlett, 2020, 31(17), 1707-1712

Production Method 4

Reaction Conditions
1.1 Reagents: Hydrogen ,  Ammonium hydroxide Catalysts: Cobalt (supported on N-doped amorphous carbonmaterial) Solvents: Water ;  20 h, 10 bar, 50 °C; 50 °C → rt
1.2 Reagents: Hydrochloric acid Solvents: Diethyl ether ;  rt
Reference
Co-Catalyzed Synthesis of Primary Amines via Reductive Amination employing Hydrogen under very mild Conditions
Elfinger, Matthias; et al, ChemSusChem, 2021, 14(11), 2360-2366

Production Method 5

Reaction Conditions
1.1 Reagents: Hydrochloric acid Solvents: Water ;  1 h, reflux; reflux → rt
Reference
Bioinspired Organocatalytic Aerobic C-H Oxidation of Amines with an ortho-Quinone Catalyst
Qin, Yan; et al, Organic Letters, 2015, 17(6), 1469-1472

Production Method 6

Reaction Conditions
1.1 rt → 155 °C; 155 °C → 180 °C; 10 h, 180 - 185 °C; 185 °C → rt
2.1 Reagents: Hydrochloric acid Solvents: Water ;  1 h, reflux; reflux → rt
Reference
Bioinspired Organocatalytic Aerobic C-H Oxidation of Amines with an ortho-Quinone Catalyst
Qin, Yan; et al, Organic Letters, 2015, 17(6), 1469-1472

1-(3-Methoxyphenyl)ethylamine hydrochloride Raw materials

1-(3-Methoxyphenyl)ethylamine hydrochloride Preparation Products

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