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80028-44-0

Basic Information
CAS No.: 80028-44-0
Name: Ethyl pyrrolidine-3-carboxylate hydrochloride
Molecular Structure:
Molecular Structure of 80028-44-0 (Ethyl pyrrolidine-3-carboxylate hydrochloride)
Formula: C7H14ClNO2
Molecular Weight: 179.6446
Synonyms: 3-Pyrrolidinecarboxylic acid, ethyl ester, hydrochloride (1:1);
EINECS:
Density:
Melting Point: 17-42°C
Boiling Point: 233.1 °C at 760 mmHg
Flash Point: 94.7 °C
Solubility:
Appearance:
Hazard Symbols: Xi
Risk Codes: 37/38-41
Safety: 26-39
Transport Information:
PSA: 38.33000
LogP: 1.28980
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  • ethyl pyrrolidine-3-carboxylate hydrochloride

  • Casno:

    80028-44-0

    ethyl pyrrolidine-3-carboxylate hydrochloride

    Min.Order: 0

    FOB Price:  USD $ 0.0-0.0/

    Manufacturers,Known for its best quality and competitve price, this chemicals we offered is widely appreciated by our customers. Storage:keep sealed and keep from direct light Package:25g,50g,100g,500g,1kg Application:pharmaceutical Transportation:Ac

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    Address:chengdu

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  • Ethyl pyrrolidine-3-carboxylate HCl

  • Casno:

    80028-44-0

    Ethyl pyrrolidine-3-carboxylate HCl

    Min.Order: 0

    FOB Price:  USD $ 0.0-0.0/

    high purity Application:Drug intermediates Materials intermediates and active molecules

    Novachemistry offers a broad range of specialty chemicals and customized synthesis services to a range of pharmaceutical, agrochemical and biochemical industries. Novachemistry has

  • NovaChemistry

    United Kingdom  |  Contact Details

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    Tel:+44 (0)208 191 7890

    Address:Unit11, Ark Business Centre, Gorden Road, Loughborough, United Kingdom

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Specification

The Ethyl pyrrolidine-3-carboxylate hydrochloride, with the CAS registry number 80028-44-0, is also known as 3-Pyrrolidinecarboxylic acid, ethyl ester, hydrochloride (1:1). This chemical's molecular formula is C7H14ClNO2 and molecular weight is 179.6446. What's more, its systematic name is Ethyl pyrrolidine-3-carboxylate hydrochloride.

Physical properties about Ethyl pyrrolidine-3-carboxylate hydrochloride are: (1)ACD/LogP: 0.52; (2)# of Rule of 5 Violations: 0; (3)ACD/BCF (pH 5.5): 1; (4)ACD/BCF (pH 7.4): 1; (5)ACD/KOC (pH 5.5): 1; (6)ACD/KOC (pH 7.4): 1; (7)#H bond acceptors: 3; (8)#H bond donors: 1; (9)#Freely Rotating Bonds: 3; (10)Polar Surface Area: 38.33 Å2; (11)Flash Point: 94.7 °C; (12)Enthalpy of Vaporization: 47.93 kJ/mol; (13)Boiling Point: 233.1 °C at 760 mmHg; (14)Vapour Pressure: 0.0462 mmHg at 25 °C.

Uses of Ethyl pyrrolidine-3-carboxylate hydrochloride: it is used to produce other chemicals. For example, it is used to produce Ethyl N-(4-pyridyl)pyrrolidine-3-carboxylate. The reaction time is 3 hours with reaction temperature of 150 °C. The yield is about 31 %.

Ethyl pyrrolidine-3-carboxylate hydrochloride can react with 4-Phenoxy-pyridine to get Ethyl N-(4-pyridyl)pyrrolidine-3-carboxylate.

You can still convert the following datas into molecular structure:
(1) SMILES: Cl.O=C(OCC)C1CNCC1
(2) InChI: InChI=1/C7H13NO2.ClH/c1-2-10-7(9)6-3-4-8-5-6;/h6,8H,2-5H2,1H3;1H
(3) InChIKey: AYYKCALHTPKNOI-UHFFFAOYAC