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Home> Encyclopedia > Hot Product Listed 5   > 5-Pyrimidinecarboxylicacid, 4-chloro-2-(methylthio)-, ethyl ester
5909-24-0 structure

5-Pyrimidinecarboxylicacid, 4-chloro-2-(methylthio)-, ethyl ester

Iupac Name:ethyl 4-chloro-2-methylsulfanylpyrimidine-5-carboxylate
CAS No.:5909-24-0
EINECS(EC#): 227-619-0
Molecular Weight:232.682
Molecular Formula:C8H9ClN2O2S (isomer)
Names and Identifiers
Synonyms

2-methylthio-4-chloro-5-ethoxycarbonylpyrimidine 2-methylthio-4-chloropyrimidine-5-carboxylic acid ethyl ester 4-chloro-2-(methylsulfanyl)pyrimidine-5-carboxylic acid ethyl ester 4-chloro-2-(methylthio)-5-pyrimidinecarboxylic acid, ethyl ester 4-chloro-2-(methylthio)pyrimidine-5-carboxylate 4-chloro-2-(methylthio)pyrimidine-5-carboxylic acid ethyl ester 4-Chloro-2-methanethiopyrimidine-5-carboxylic acid ethyl ester 4-chloro-2-methylsulfanyl-5-pyrimidinecarboxylate ethyl ester 4-chloro-2-methylsulfanyl-pyrimidine-5-carboxylic acid ethyl ester 4-chloro-2-methylsulfanylpyrimidine-5-carboxylic acid ethyl ester 4-chloro-2-methylsulfanyl-pyrimidine-5-carboxylicacidethylester 4-chloro-2-methylthio-5-pyrimidine carboxylic acid ethyl ester 4-chloro-2-methylthio-5-pyrimidinecarboxylate ethyl ester 4-chloro-2-methylthio-5-pyrimidinecarboxylic acid ethyl ester 4-chloro-5-(ethoxycarbonyl)-2-(methylthio)pyrimidine 4-chloro-5-carbethoxy-2-methylthiopyrimidine 4-chloro-5-ethoxycarbonyl-2-methylthiopyrimidine 4-chloro-5-ethoxycarbonyl-2-methylthio-pyrimidine 5-ethoxycarbonyl-4-chloro-2-methylthiopyrimidine 5-pyrimidinecarboxylic acid, 4-chloro-2-(methylthio)-, ethyl ester 6N-537S 909e240 A9818 AB0006938 AB1011887 AC1L2YJY AC1Q34MC AC-2398 AC-26681 ACMC-209MA5 AJ-11592 AK-24033 AKOS003106956 AM20100437 AMX10165 AN-13980 ANW-33147 AX8011166 bbv-34552640 BG01532342 BR-24033 c-13634 cc-27990 CE-118 CJ-00868 CS-M1026 DB-010273 DTXSID20207832 E0841 einecs 227-619-0 EN001494 ethyl 4-chloro-2-(methylmercapto)pyrimidine-5-carboxylate ethyl 4-chloro-2-(methylsulfanyl)-5-pyrimidinecarboxylate ethyl 4-chloro-2-(methylsulfanyl)-5-pyrimidinecarboxylate # ethyl 4-chloro-2-(methylsulfanyl)pyrimidine-5-carboxylate ethyl 4-chloro-2-(methylthio)-5-pyrimidinecarboxylate ethyl 4-chloro-2-(methylthio)pyrimidin-5-carboxylate ethyl 4-chloro-2-(methylthio)pyrimidine -5-carboxylate ethyl 4-chloro-2-(methylthio)pyrimidine-5-carb oxylate ethyl 4-chloro-2-(methylthio)-pyrimidine-5-carboxylate ethyl 4-chloro-2-(methylthio)pyrimidine-5-carboxylate ethyl 4-chloro-2(methylthio)pyrimidine-5-carboxylate ethyl 4-chloro-2-(methylthio)pyrimidine-5-carboxylate 98% ethyl 4-chloro-2-(methylthio)pyrimidine-5-carboxylate, 98% 5g ethyl 4-chloro-2-methylsulfanyl-5-pyrimidinecarboxylate ethyl 4-chloro-2-methylsulfanyl-pyrimidine-5-carboxylate ethyl 4-chloro-2-methylsulfanylpyrimidine-5-carboxylate ethyl 4-chloro-2-methylthio -5-pyrimidinecarboxylate ethyl 4-chloro-2-methylthio-5-pyrimidine carboxylate ethyl 4-chloro-2-methylthio-5-pyrimidinecarboxylate ethyl 4-chloro-2-methylthio-5-pyrimidine-carboxylate ethyl 4-chloro-2-methylthio-5-pyrimidinecarboxylate, 98% ethyl 4-chloro-2-methylthiopyrimidine 5-carboxylate ethyl 4-chloro-2-methylthiopyrimidine-5-carboxylate ethyl4-amino-2-(methylthio)pyrimidin-5-carboxylate ethyl4-chloro-2-(methylthio)pyrimidine-5-carboxylate ethyl-4-chloro-2-methylthio-5-pyrimidine carboxylate ethyl-4-chloro-2-methylthio-5-pyrimidinecarboxylate ethyl-4-chloro-2-methylthio-5-pyrimidine-carboxylate ethyl4-chloro-2-methylthio-5-pyrimidinecarboxylate FT-0083143 FT-0626076 FT-0646364 GEO-01330 HC210014 HE003318 HE216923 HP21015 I03-0294 J-520986 KB-51228 KS-000003RG KSC496O3R M-1798 MCULE-3822714426 mfcd00006085 MOLPORT-000-155-197 nsc123534 nsc-123534 or6605 PB21605 PUBCHEM7346 Q683 QC-1591 RP05611 RP28040 RTC-061878 S03-0004 SBB059077 SC-25932 SCHEMBL188686 SNNHLSHDDGJVDM-UHFFFAOYSA-N ST24030600 STK727415 STOCK1S-51298 TC-061878 TL8003781 TRA0076280 W-105345 W-203215 Y4965 ZB003980 ZINC119543 ZLCHEM 523 zx-at006042

Inchi
InChI=1S/C8H9ClN2O2S/c1-3-13-7(12)5-4-10-8(14-2)11-6(5)9/h4H,3H2,1-2H3
InChkey
SNNHLSHDDGJVDM-UHFFFAOYSA-N
Canonical Smiles
CCOC(=O)C1=CN=C(N=C1Cl)SC
Properties
Appearance
yellow white powdery crystal
Density
1.37
Melting Point
60-63℃
Boiling Point
335.7 °C at 760 mmHg
Refractive Index
1.568
Flash Point
156.8 °C
Stability
Stable under normal temperatures and pressures.
HS Code
2933599090
Storage temp
Keep Cold
Safety and Handling
Hazard Codes
Xi
Risk Statements
R36/37/38
Safety Statements
S26;S36
Safety

Hazard Codes: IrritantXi
Risk Statements: 36/37/38 
R36/37/38: Irritating to eyes, respiratory system and skin.
Safety Statements: 26-36 
S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. 
S36: Wear suitable protective clothing.
WGK Germany: 3
Hazard Note: Irritant
HazardClass: IRRITANT, KEEP COLD

MSDS

2.Hazard identification

2.1 Classification of the substance or mixture

Skin irritation, Category 2

Eye irritation, Category 2

Specific target organ toxicity \u2013 single exposure, Category 3

2.2 GHS label elements, including precautionary statements

Pictogram(s)
Signal word

Warning

Hazard statement(s)

H315 Causes skin irritation

H319 Causes serious eye irritation

H335 May cause respiratory irritation

Precautionary statement(s)
Prevention

P264 Wash ... thoroughly after handling.

P280 Wear protective gloves/protective clothing/eye protection/face protection.

P261 Avoid breathing dust/fume/gas/mist/vapours/spray.

P271 Use only outdoors or in a well-ventilated area.

Response

P302+P352 IF ON SKIN: Wash with plenty of water/...

P321 Specific treatment (see ... on this label).

P332+P313 If skin irritation occurs: Get medical advice/attention.

P362+P364 Take off contaminated clothing and wash it before reuse.

P305+P351+P338 IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue rinsing.

P337+P313 If eye irritation persists: Get medical advice/attention.

P304+P340 IF INHALED: Remove person to fresh air and keep comfortable for breathing.

P312 Call a POISON CENTER/doctor/\u2026if you feel unwell.

Storage

P403+P233 Store in a well-ventilated place. Keep container tightly closed.

P405 Store locked up.

Disposal

P501 Dispose of contents/container to ...

2.3 Other hazards which do not result in classification

none

Precursor and Product
Computational chemical data
  • Molecular Weight:232.682g/mol
  • Molecular Formula:C8H9ClN2O2S
  • Compound Is Canonicalized:True
  • Exact Mass:232.007
  • Monoisotopic Mass:232.007
  • Complexity:206
  • Rotatable Bond Count:4
  • Hydrogen Bond Donor Count:0
  • Hydrogen Bond Acceptor Count:5
  • Topological Polar Surface Area:77.4A^2
  • Heavy Atom Count:14
  • Defined Atom Stereocenter Count:0
  • Undefined Atom Stereocenter Count:0
  • Defined Bond Stereocenter Count:0
  • Undefined Bond Stereocenter Count:0
  • Isotope Atom Count:0
  • Covalently-Bonded Unit Count:1
  • CACTVS Substructure Key Fingerprint: AAADccBzMABEAAAAAAAAAAAAAAAAAAAAAAAsAAAAAAAAAAABgAAAHgYAAAAADALhmiavmJYIFAio AhD3bACA0ClVBKABUCEoTlCADIhAaEgGBIgKAAJAJOAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA AA==
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Recommended Suppliers
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  • Fax:+86-311-85355123
  • Tel:86-571-85829152
  • Fax:86-571-85829153
  • Tel:86-21-33758180
  • Fax:86-21-51685790
  • Tel:+86-0592-5567629
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  • Tel:86-25-83697070
  • Fax:86-25-83453275
  • Tel:86-21-34226250
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  • Tel:86-755-33239182
  • Fax:86-755-33233381
  • Tel:86-21-61124658
  • Fax:86-21-61294103
  • Tel:86-371-86658258
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