Cas no 99951-95-8 (6-Chloro-2-(methylthio)-4-pyrimidinecarboxylic Acid)
99951-95-8 structure
Product Name:6-Chloro-2-(methylthio)-4-pyrimidinecarboxylic Acid
CAS No:99951-95-8
MF:C6H5ClN2O2S
MW:204.634098768234
CID:4387724
PubChem ID:14850463
Update Time:2025-04-24
6-Chloro-2-(methylthio)-4-pyrimidinecarboxylic Acid Chemical and Physical Properties
Names and Identifiers
-
- 4-Pyrimidinecarboxylic acid, 6-chloro-2-(methylthio)-
- Z1269190140
- EN300-7864027
- 99951-95-8
- 872-834-0
- 6-Chloro-2-(methylthio)-4-pyrimidinecarboxylic Acid
- ZDA95195
- 6-chloro-2-(methylsulfanyl)pyrimidine-4-carboxylic acid
- SCHEMBL5848301
- 6-chloro-2-methylsulfanylpyrimidine-4-carboxylic acid
- 6-Chloro-2-(methylthio)pyrimidine-4-carboxylic acid
- 6-chloro-2-(methylsulfanyl)pyrimidine-4-carboxyli c acid
-
- Inchi： 1S/C6H5ClN2O2S/c1-12-6-8-3(5(10)11)2-4(7)9-6/h2H,1H3,(H,10,11)
- InChI Key： PELVWMMDKVPHOA-UHFFFAOYSA-N
- SMILES： C1(SC)=NC(Cl)=CC(C(O)=O)=N1
Computed Properties
- Exact Mass: 203.9760263Da
- Monoisotopic Mass: 203.9760263Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 12
- Rotatable Bond Count: 2
- Complexity: 181
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 1.9
- Topological Polar Surface Area: 88.4?2
6-Chloro-2-(methylthio)-4-pyrimidinecarboxylic Acid Security Information
- Signal Word：warning
- Hazard Statement： H303May be harmful if swallowed+H313Skin contact may be harmful+H333Inhalation may be harmful to the body
- Warning Statement： P264+P280+P305+P351+P338+P337+P313
- Safety Instruction： H303+H313+H333
- Storage Condition：storage at -4℃ (1-2weeks), longer storage period at -20℃ (1-2years)
6-Chloro-2-(methylthio)-4-pyrimidinecarboxylic Acid Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| Alichem | A089005545-5g |
6-Chloro-2-(methylthio)pyrimidine-4-carboxylic acid |
99951-95-8 | 95% | 5g |
$1721.11 | 2023-08-31 | |
| Alichem | A089005545-10g |
6-Chloro-2-(methylthio)pyrimidine-4-carboxylic acid |
99951-95-8 | 95% | 10g |
$2510.08 | 2023-08-31 | |
| Alichem | A089005545-25g |
6-Chloro-2-(methylthio)pyrimidine-4-carboxylic acid |
99951-95-8 | 95% | 25g |
$4789.20 | 2023-08-31 | |
| TRC | C602018-100mg |
6-Chloro-2-(methylthio)-4-pyrimidinecarboxylic Acid |
99951-95-8 | 100mg |
$270.00 | 2023-05-18 | ||
| TRC | C602018-500mg |
6-Chloro-2-(methylthio)-4-pyrimidinecarboxylic Acid |
99951-95-8 | 500mg |
$ 1200.00 | 2023-09-08 | ||
| TRC | C602018-1g |
6-Chloro-2-(methylthio)-4-pyrimidinecarboxylic Acid |
99951-95-8 | 1g |
$ 1700.00 | 2022-06-06 | ||
| TRC | C602018-1000mg |
6-Chloro-2-(methylthio)-4-pyrimidinecarboxylic Acid |
99951-95-8 | 1g |
$2050.00 | 2023-05-18 | ||
| Enamine | EN300-7864027-0.05g |
6-chloro-2-(methylsulfanyl)pyrimidine-4-carboxylic acid |
99951-95-8 | 95.0% | 0.05g |
$293.0 | 2025-03-21 | |
| Enamine | EN300-7864027-0.1g |
6-chloro-2-(methylsulfanyl)pyrimidine-4-carboxylic acid |
99951-95-8 | 95.0% | 0.1g |
$437.0 | 2025-03-21 | |
| Enamine | EN300-7864027-0.25g |
6-chloro-2-(methylsulfanyl)pyrimidine-4-carboxylic acid |
99951-95-8 | 95.0% | 0.25g |
$623.0 | 2025-03-21 |
6-Chloro-2-(methylthio)-4-pyrimidinecarboxylic Acid Related Literature
-
Gang Pan,Yi-jie Bao,Jie Xu,Tao Liu,Cheng Liu,Yan-yan Qiu,Xiao-jing Shi,Hui Yu,Ting-ting Jia,Xia Yuan,Ze-ting Yuan,Yi-jun Cao RSC Adv., 2016,6, 42109-42119
-
Bo Wei,Zhenyu Liu,Chen Xie,Shu Yang,Wentao Tang,Aiwei Gu,Wing-Tak Wong,Ka-Leung Wong J. Mater. Chem. C, 2015,3, 12322-12327
-
J. Zagora,M. Vosla?,L. Schreiberová,I. Schreiber Phys. Chem. Chem. Phys., 2002,4, 1284-1291
-
Erika A. Cobar,Paul R. Horn,Robert G. Bergman,Martin Head-Gordon Phys. Chem. Chem. Phys., 2012,14, 15328-15339
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