Ethyl thiazole-5-carboxylate

HCID 459108CAS 32955-22-9
Substructure searchFind similar structures

Basic information

Standard SMILES
CCOC(=O)c1cncs1
InChIKey
CIPMPQGRFNDLAP-UHFFFAOYSA-N
Molecular formula
C6H7NO2S
Average molar mass
157.19 g/mol
Monoisotopic mass
157.01974946

Names & identifiers

Preferred name
Ethyl thiazole-5-carboxylate
IUPAC
ethyl 1,3-thiazole-5-carboxylate
English name
Ethyl thiazole-5-carboxylate
Molecular formula
C6H7NO2S
Molecular weight
157.19

Names & synonyms

Ethyl thiazole-5-carboxylate32955-22-9DTXSID30332604RefChem:345012DTXCID80283697Ethyl 5-thiazolecarboxylateethyl 1,3-thiazole-5-carboxylateMFCD062050695-Thiazolecarboxylic acid ethyl ester5-Thiazolecarboxylic acid, ethyl ester5-(Carbethoxy)thiazole5-(Ethoxycarbonyl)thiazole
Show more names
RARECHEM AL BI 1261thyl thiazole-5-carboxylate5-(Ethoxycarbonyl)-1,3-thiazoleEthyl 1,3-thiazole-5-carboxylate 98%Thiazole-5-carboxylic acid ethyl ester
Ethyl Thiazol-5-carboxylateSCHEMBL290564SCHEMBL969584Ethyl1,3-thiazole-5-carboxylateCIPMPQGRFNDLAP-UHFFFAOYSA-NEthyl-1,3 thiazole-5-carboxylateSBB053919AKOS005146155

Database identifiers

CAS
32955-22-9
PubChem CID
459108
DTXSID
DTXSID30332604

Properties

Computed structural properties

XLogP
1.5
Topological polar surface area
67.4 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
3
Heavy atoms
10

Physicochemical properties

Boiling point
103 · 103-104 °C(Press: 13 Torr)
Density
1.242 · 1.242±0.06 g/cm3(Predicted)
storage temp.
2 · Sealed in dry,2-8°C
pka
0.9 · 0.90±0.10(Predicted)
Appearance
Light yellow to yellow Liquid
InChI
InChI=1S/C6H7NO2S/c1-2-9-6(8)5-3-7-4-10-5/h3-4H,2H2,1H3

Safety & regulation

Safety data

hs_code
2934100090
Signal word
Warning
Symbol(GHS)
GHS07
hazard_code
Xi
hazard_note
Irritant/Keep Cold
Hazard statements
H302-H315-H319-H335

Chemistry & industry

Applications

UsesThiazole-5-carboxylic acid ethyl ester is an ester derivative that can be used as a pharmaceutical intermediate.

Upstream & downstream products

Suppliers50 total

苏州道澜生物医药科技有限公司15952404857 · [email protected]
上海凛南医药科技有限公司15900633975;13262632028
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
合肥翰刚医药科技有限公司+8618062405514 · [email protected]
Suzhou ARTK Medchem Co., Ltd.+86-18168183658 · [email protected]

Related reactions

65 records
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Linked notes

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