Basic information
- CAS
14527-44-7- Standard SMILES
COC(=O)c1cncs1- InChIKey
XDIBWBYTRTUUBJ-UHFFFAOYSA-N- Molecular formula
- C5H5NO2S
- Average molar mass
- 143.17 g/mol
- Monoisotopic mass
- 143.0040994
Names & identifiers
- Preferred name
- Methyl 1,3-thiazole-5-carboxylate
- IUPAC
- methyl 1,3-thiazole-5-carboxylate
- English name
- Methyl 5-thiazolecarboxylate
- Molecular formula
- C5H5NO2S
- Molecular weight
- 143.16
Names & synonyms
methyl 1,3-thiazole-5-carboxylateRefChem:812491966-422-0Methyl thiazole-5-carboxylate14527-44-7methyl 5-thiazolecarboxylate5-Thiazolecarboxylic acid, methyl esterMFCD03788563NSC321257methylthiazole-5-carboxylateCS-M1604AKOS005146045
Show more names
RARECHEM AL BF 1261Methyl 5-thiazolecar5-thiazole carboxylate.5-(Methoxycarbonyl)-1,3-thiazoleMethyl 1,3-thiazole-5-carboxylate 98%Thiazole-5-carboxylic acid methyl ester
NSC 321257NSC-321257AB16044AC-7647DS-0703SY004484AE-562/40207545AM20080344
Database identifiers
- CAS
14527-44-7- PubChem CID
- 331117
- DTXSID
DTXSID20317869- EC Number
- 966-422-0
Properties
Computed structural properties
- XLogP
- 1.1
- Topological polar surface area
- 67.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 118
Physicochemical properties
- Melting point
- 68 · 68-69°C
- Boiling point
- 87 · 87-90°C (10 mmHg)
- Density
- 1.45 · 1.45
- storage temp.
- Keep in dark place,Sealed in dry,Room Temperature
- pka
- 0.8 · 0.80±0.10(Predicted)
- Appearance
- Off-white to light yellow Solid
- CAS DataBase Reference
- 14527 · 14527-44-7(CAS DataBase Reference)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319-H335
- Precautionary statements
- 271 · P271-P280
- Hazard Codes
- Xn
- Risk Statements
- 36 · 36/37/38-22
- Safety Statements
- 26 · 26-36/37/39
- Hazard Note
- Harmful
- HS Code
- 2934100090 · 2934100090
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
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety data
- hs_code
- 2934100090
- risk_code
- 36/37/38-22
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xn
- hazard_note
- Harmful
- safety_code
- 26-36/37/39
- Hazard statements
- H315-H319-H335
- Precautionary statements
- P271-P280
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Downstream products
Suppliers90 total
上海康恩博医药科技有限公司17510465506 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
上海凌富药物研究有限公司+86(21)5895 0110 19945755304 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
Suzhou ARTK Medchem Co., Ltd.+86-18168183658 · [email protected]
Baoji Guokang Healthchem co.,ltd+8615604608665 15604608665 · [email protected]
西安美科生物科技有限公司029-18710438009 18710438009 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
上海弘顺生物科技有限公司15901914505 · [email protected]
Related reactions
8 records
Compound notes
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