Cas no 54954-73-3 (Methyl 3-quinuclidinecarboxylate hydrochloride)

Methyl 3-quinuclidinecarboxylate hydrochloride structure
54954-73-3 structure
Product Name:Methyl 3-quinuclidinecarboxylate hydrochloride
CAS No:54954-73-3
MF:C9H16ClNO2
MW:205.681841850281
MDL:MFCD06798962
CID:89835
PubChem ID:24721307
Update Time:2025-04-18

Methyl 3-quinuclidinecarboxylate hydrochloride Chemical and Physical Properties

Names and Identifiers

    • Methyl 3-quinuclidinecarboxylate hydrochloride
    • 3-Quinuclidinecarboxylic acid methyl ester hydrochloride
    • methyl 1-azabicyclo[2.2.2]octane-3-carboxylate,hydrochloride
    • 3-(methoxycarbonyl)quinuclidine hydrochloride
    • 3-Carbomethoxy-1-azabicyclo[2.2.2]octane hydrochloride
    • 3-methoxycarbonyl-1-azabicyclo[2.2.2]octane hydrochloride
    • 3-methoxycarbonyl-quinuclidine HCl
    • Chinuclidin-3-carbonsaeure-methylester,Hydrochlorid
    • methyl quinuclidine-3-carboxylate hydrochloride
    • OR0654
    • quinuclidine-3-carboxylic acid methyl ester,hydrochloride
    • AKOS027327438
    • methyl 1-azabicyclo[2.2.2]octane-3-carboxylate hydrochloride
    • MFCD01073582
    • SCHEMBL5200635
    • FT-0730894
    • DTXSID70641040
    • methyl 1-azabicyclo[2.2.2]octane-3-carboxylate;hydrochloride
    • A913942
    • 3-(methoxycarbonyl)quinuclidine hydrochloride; OR0654
    • Methyl 1-azabicyclo[2.2.2]octane-3-carboxylate--hydrogen chloride (1/1)
    • 54954-73-3
    • AS-67579
    • DB-083276
    • MDL: MFCD06798962
    • Inchi: 1S/C9H15NO2.ClH/c1-12-9(11)8-6-10-4-2-7(8)3-5-10;/h7-8H,2-6H2,1H3;1H
    • InChI Key: NDTQASSGEAZYOT-UHFFFAOYSA-N
    • SMILES: Cl.O(C)C(C1CN2CCC1CC2)=O
    • BRN: 4272456

Computed Properties

  • Exact Mass: 205.08700
  • Monoisotopic Mass: 205.087
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 2
  • Complexity: 185
  • Covalently-Bonded Unit Count: 2
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 1
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 29.5A^2

Experimental Properties

  • Melting Point: 160°C (dec.)
  • Boiling Point: 221.5 oCat 760 mmHg
  • Flash Point: 85 oC
  • PSA: 29.54000
  • LogP: 1.24110
  • Sensitiveness: Hygroscopic

Methyl 3-quinuclidinecarboxylate hydrochloride Security Information

  • Hazard Statement: Irritant
  • Hazard Category Code: 36/37/38
  • Safety Instruction: S26-S36
  • Hazardous Material Identification: Xi
  • Risk Phrases:R36/37/38
  • Safety Term:S26;S36

Methyl 3-quinuclidinecarboxylate hydrochloride Customs Data

  • HS CODE:2933990090
  • Customs Data:

    China Customs Code:

    2933990090

    Overview:

    2933990090. Other heterocyclic compounds containing only nitrogen heteroatoms. VAT:17.0%. Tax refund rate:13.0%. Regulatory conditions:nothing. MFN tariff:6.5%. general tariff:20.0%

    Declaration elements:

    Product Name, component content, use to, Please indicate the appearance of Urotropine, 6- caprolactam please indicate the appearance, Signing date

    Summary:

    2933990090. heterocyclic compounds with nitrogen hetero-atom(s) only. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

Methyl 3-quinuclidinecarboxylate hydrochloride Pricemore >>

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