Basic information
- CAS
34418-48-9- Standard SMILES
Cc1nc(-c2ccccn2)sc1C(=O)O- InChIKey
QFDHWPOPCNNAOI-UHFFFAOYSA-N- Molecular formula
- C10H8N2O2S
- Average molar mass
- 220.25 g/mol
- Monoisotopic mass
- 220.03064868
Names & identifiers
- Preferred name
- 2-(2-Pyridyl)-4-methylthiazole-5-carboxylic acid
- IUPAC
- 4-methyl-2-pyridin-2-yl-1,3-thiazole-5-carboxylic acid
- English name
- 4-METHYL-2-PYRIDIN-2-YL-1,3-THIAZOLE-5-CARBOXYLIC ACID
- Molecular formula
- C10H8N2O2S
- Molecular weight
- 220.25
Names & synonyms
2-(2-Pyridyl)-4-methylthiazole-5-carboxylic acid4-Methyl-2-(2-pyridinyl)-5-thiazolecarboxylic acidRefChem:454424623-796-734418-48-94-Methyl-2-(pyridin-2-yl)thiazole-5-carboxylic acid4-methyl-2-pyridin-2-yl-1,3-thiazole-5-carboxylic acid4-Methyl-2-(Pyridin-2-Yl)-1,3-Thiazole-5-Carboxylic AcidMFCD013163642-(2-Pyridyl)-4-methyl-thiazole-5-Carboxylic Acid4-Methyl-2-(2-pyridyl)thiazole-5-carboxylic acid4-Methyl-2-pyridin-2-yl-thiazole-5-carboxylic acid
Show more names
4-methyl-2-pyridin-2-yl-1,3-thiazole-5-carboxylicaci5-Thiazolecarboxylic acid, 4-Methyl-2-(2-pyridinyl)-
5-Thiazolecarboxylic acid, 4-methyl-2-(2-pyridyl)-4-Methyl-2-(2-pyridyl)-5-thiazolecarboxylic acid4-methyl-2-(2-pyridyl)-1,3-thiazole-5-carboxylic acidOprea1_650936MLS000716739SCHEMBL5960824-Methyl-2-(pyridin-2-yl)thiazole-5-carboxylicacidCHEMBL1600925
Database identifiers
- CAS
34418-48-9- PubChem CID
- 214841
- DTXSID
DTXSID50187991- ChEMBL
CHEMBL1600925- EC Number
- 623-796-7
- Nikkaji
- J59.604C
Properties
Computed structural properties
- XLogP
- 1.8
- Topological polar surface area
- 91.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 250
Experimental & physicochemical properties
Solubility>33 [ug/mL] (The mean of the results at pH 7.4)
Physicochemical properties
- Melting point
- 221 · 221-226 °C (D)
- storage temp.
- 2 · 2-8°C
- solubility
- 10 mg/ml; · DMF: 10 mg/ml; DMSO: 15 mg/ml; DMSO:PBS(pH 7.2) (1:2): 0.3 mg/ml; Ethanol: 0.3 mg/ml
- form
- A crystalline solid
- InChI
- 1S/C10H8N2O2S/c1-6-8(10(13)14)15-9(12-6)7-4-2-3-5-11-7/h2-5H,1H3,(H,13,14)
- InChIKey
- QFDHWPOPCNNAOI-UHFFFAOYSA-N
- SMILES
- Cc1nc(sc1C(O)=O)-c2ccccn2
- UNSPSC Code
- 12352100 · 12352100
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 319 · H319
- Precautionary statements
- 305 · P305+P351+P338
- PPE
- 95 · dust mask type N95 (US), Eyeshields, Gloves
- Hazard Codes
- Xi
- Risk Statements
- 36 · 36
- Safety Statements
- 26 · 26
- WGK Germany
- 3 · 3
- HazardClass
- IRRITANT
- Storage Class
- 11 · 11 - Combustible Solids
- Hazard Classifications
- 2 · Eye Irrit. 2
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Warning
H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
P264+P265, P280, P305+P351+P338, and P337+P317 (click each P-code to see the statement)
Aggregated GHS information provided per 43 reports by companies from 2 notifications to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesEye Irrit. 2 (100%)
Safety data
- PPE
- dust mask type N95 (US), Eyeshields, Gloves
- wgk
- 3
- risk_code
- 36
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xi
- safety_code
- 26
- hazard_class
- IRRITANT
- Storage Class
- 11 - Combustible Solids
- Hazard statements
- H319
- Hazard Classifications
- Eye Irrit. 2
- Precautionary statements
- P305+P351+P338
Chemistry & industry
Applications
Description2-(2-pyridyl)-4-methyl-Thiazole-5-carboxylic acid is a synthetic intermediate useful for pharmaceutical synthesis.
Uses2-(2-Pyridyl)-4-methyl-thiazole-5-carboxylic acid is a synthetic intermediate useful for pharmaceutical synthesis.
Suppliers33 total
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
阿法埃莎（中国）化学有限公司400-6106006 · [email protected]
安耐吉化学&3A（安徽泽升科技股份有限公司）400-0056266 · [email protected]
武汉凯威斯科技有限公司86-027-67849912 · [email protected]
梯希爱（上海）化工贸易有限公司021-61109150 · [email protected]
上海瀚鸿科技股份有限公司021-54306202 13764082696 · [email protected]
MedBio脉铂医药021-69568360 18916172912 · [email protected]
PT CHEM GROUP LIMITED+86-85511178; +86-85511178 · [email protected]
成都零六生物科技有限公司400-1166-196 13458535857 · [email protected]
Sigma-Aldrich西格玛奥德里奇(上海)贸易有限公司021-61415566 800-8193336 · [email protected]
盐城希曼生物科技有限公司0515-88280676; 18921872653 · [email protected]
上海阿拉丁生化科技股份有限公司6206333 13167063860 · [email protected]
上海源叶生物科技有限公司18916372613 · [email protected]
山东小野化学股份有限公司0539-6362799 20）
上海贤鼎生物科技有限公司021-021-52271985 17721149837 · [email protected]
杭州洁汉化工有限公司+86-571-86217390; +8618058761490 · [email protected]
常州探索化学有限公司15295164949 · [email protected]
江苏艾康生物医药研发有限公司025-58859352 19370895928 · [email protected]
福州福康医药科技有限公司18150835816 · [email protected]
上海宏叶生物科技有限公司400-9205774 400-920-5774 · [email protected]
深圳聚合生化科技有限公司+86-400-002-6226 13028896684 · [email protected]
徐州砥研医药科技有限公司0516-0516-88997009 18651776937 · [email protected]
Aladdin Scientific[email protected]
常州探索化学有限公司+8615295164949 · [email protected]
上海皓鸿生物医药科技有限公司400-8210725 4008210725 · [email protected]
ANHUI WITOP BIOTECH CO., LTD+8618071025641 · [email protected]
Alchem Pharmtech,Inc.8485655694 · [email protected]
上海永誉化工有限公司86-29-81325371 · [email protected]
上海研邦医药科技有限公司15618536883 · [email protected]
重庆卡兰医药有限公司[email protected]
北京百灵威科技有限公司18210857532 18210857532 · [email protected]
Hefei TNJ Chemical Industry Co.,Ltd.+86-0551-65418671 +86-189 4982 3763 · [email protected]
宝鸡缔都医药化工有限公司029-029-81148929 17792602132 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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