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89793-12-4

Basic Information
CAS No.: 89793-12-4
Name: 5-Pyrimidinecarboxylicacid, 2-chloro-, ethyl ester
Article Data: 19
Cas Database
Molecular Structure:
Molecular Structure of 89793-12-4 (5-Pyrimidinecarboxylicacid, 2-chloro-, ethyl ester)
Formula: C7H7ClN2O2
Molecular Weight: 186.598
Synonyms: 2-Chloro-5-(ethoxycarbonyl)pyrimidine;2-Chloropyrimidine-5-carboxylic acid ethyl ester;Ethyl-2-chloro-5-pyrimidinecarboxylate;
EINECS: N/A
Density: 1.312 g/cm3
Melting Point: 52-60℃
Boiling Point: 314.189 °C at 760 mmHg
Flash Point: 143.816 °C
Solubility: N/A
Appearance: N/A
Hazard Symbols: N/A
Risk Codes: 20/21/22
Safety: 36/37
Transport Information: N/A
PSA: 52.08000
LogP: 1.30670
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  • Ethyl 2-chloropyrimidine-5-carboxylate

  • Casno:

    89793-12-4

    Ethyl 2-chloropyrimidine-5-carboxylate

    Min.Order: 0

    FOB Price:  USD $ 0.0-0.0/

    1.High quality2. Free sample available3. Competitive price4.Experienced service team5.Fast delivery6.Considerate after-sale service Package:as per customers' request Application:Biological reagent Port:Beijing airport

    About us Innobio Pharm Co.,Ltd. is a high tech company, focused on meeting research and production needs for pharmaceutical, biotechnology, diagnostic, personal care, agrochemical

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  • 89793-12-4

  • Casno:

    89793-12-4

    89793-12-4

    Min.Order: 0

    FOB Price:  USD $ 0.0-0.0/

    Nanjing Chemlin Chemical Industry Co., Ltd was established in Aug,1999, located in the industrial park of Nanjing University of Technology, It is a private enterprises in Jiangsu Province with 1200 square meters’ R&D center. Our R&D center has a well

    Nanjing Chemlin Chemical Industry Co., Ltd was established in Aug,1999, located in the industrial park of Nanjing University of Technology, It is a private enterprises in Jiangsu P

  •  Nanjing Chemlin Chemical Co., Ltd.

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  • ETHYL 2-CHLOROPYRIMIDINE-5-CARBOXYLATE

  • Casno:

    89793-12-4

    ETHYL 2-CHLOROPYRIMIDINE-5-CARBOXYLATE

    Min.Order: 0

    FOB Price:  USD $ 0.0-0.0/

    FINETECH INDUSTRY LIMITED is a LONDON based CRO company providing drug discovery & development services to worldwide clients. FINETECH INDUSTRY LIMITED supplies the ETHYL 2-CHLOROPYRIMIDINE-5-CARBOXYLATE, CAS:89793-12-4 with the most competitive pric

    Finetech Industry Limited is a company in England,which specializing in developing, manufacturing and marketing fine organic compounds and intermediates for the fine chemical and p

  •  Finetech Industry Limited

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    Tel:86-27-87465837

    Address:wuhan

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Specification

The 5-Pyrimidinecarboxylicacid, 2-chloro-, ethyl ester, with CAS registry number 89793-12-4, has the systematic name of ethyl 2-chloropyrimidine-5-carboxylate. Besides this chemical, it is also called 2-chloro-pyrimidine-5-carboxylic acid ethyl ester. And the chemical formula of this chemical is C7H7ClN2O2.

Physical properties of 5-Pyrimidinecarboxylicacid, 2-chloro-, ethyl ester: (1)ACD/LogP: 0.60; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1; (4)ACD/LogD (pH 7.4): 1; (5)ACD/BCF (pH 5.5): 3; (6)ACD/BCF (pH 7.4): 3; (7)ACD/KOC (pH 5.5): 71; (8)ACD/KOC (pH 7.4): 71; (9)#H bond acceptors: 4; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 52.08 Å2; (13)Index of Refraction: 1.527; (14)Molar Refractivity: 43.736 cm3; (15)Molar Volume: 142.231 cm3; (16)Polarizability: 17.338×10-24cm3; (17)Surface Tension: 48.877 dyne/cm; (18)Enthalpy of Vaporization: 55.533 kJ/mol; (19)Vapour Pressure: 0 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(OCC)c1cnc(Cl)nc1
(2)InChI: InChI=1/C7H7ClN2O2/c1-2-12-6(11)5-3-9-7(8)10-4-5/h3-4H,2H2,1H3
(3)InChIKey: IEMKQRSOAOPKRJ-UHFFFAOYAN
(4)Std. InChI: InChI=1S/C7H7ClN2O2/c1-2-12-6(11)5-3-9-7(8)10-4-5/h3-4H,2H2,1H3
(5)Std. InChIKey: IEMKQRSOAOPKRJ-UHFFFAOYSA-N