Ethyl 2-pyridinecarboxylate

HCID 17307
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Basic information

CAS
2524-52-9
Standard SMILES
CCOC(=O)c1ccccn1
InChIKey
FQYYIPZPELSLDK-UHFFFAOYSA-N
Molecular formula
C8H9NO2
Average molar mass
151.16 g/mol
Monoisotopic mass
151.06332853

Names & identifiers

Preferred name
Ethyl 2-pyridinecarboxylate
IUPAC
ethyl pyridine-2-carboxylate
English name
Ethyl picolinate
Molecular formula
C8H9NO2
Molecular weight
151.16

Names & synonyms

ETHYL PICOLINATE2524-52-9Ethyl pyridine-2-carboxylateEthyl 2-pyridinecarboxylate2-Pyridinecarboxylic acid, ethyl ester2-pyridinecarboxylic acid ethyl esterRW5EU98AZQNSC-959NSC-31651DTXSID9062489RefChem:139045DTXCID9037246
Show more names
Ethyl picoliteEthyl pyridinatePyridine-2-A Ethyl2-ETHYL PICOLINATERARECHEM AL BI 0182Ethyl picolinate ,99%Ethyl 2-picolinate 99%Ethyl 2-picolinate ,99%
219-758-0Ethyl 2-picolinate2-Picolinic acid ethyl esterPicolinic acid ethyl ester2-(Ethoxycarbonyl)pyridinePicolinic acid, ethyl esterMFCD00006292Ethyl2-picolinate

Database identifiers

CAS
2524-52-9
PubChem CID
17307
DTXSID
DTXSID9062489
ChEMBL
CHEMBL2251607
UNII
RW5EU98AZQ
EC Number
219-758-0
Nikkaji
J27.973K

Properties

Computed structural properties

XLogP
0.9
Topological polar surface area
39.2 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
3
Heavy atoms
11

Experimental & physicochemical properties

SpringerMaterials PropertiesChemical shift
FragrancesFragrance Ingredient (2-Pyridinecarboxylic acid, ethyl ester) -> IFRA transparency List

Physicochemical properties

Melting point
2 °C · 2 °C (lit.)
Boiling point
240 · 240-241 °C (lit.)
Density
1.119 g/mL · 1.119 g/mL at 25 °C (lit.)
refractive index
20 · n20/D 1.511(lit.)
Flash point
225 °F · 225 °F
storage temp.
Inert atmosphere,Room Temperature

Safety & regulation

GHS classification

GHS Classification · 5 items

This chemical does not meet GHS hazard criteria for 66.7% (90 of 135) of all reports.

Warning

H315 (29.6%): Causes skin irritation [Warning Skin corrosion/irritation]

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 135 reports by companies from 6 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Hazard information

Regulatory Information · 2 items

Chemical: 2-Pyridinecarboxylic acid, ethyl ester

2-Pyridinecarboxylic acid, ethyl ester: Does not have an individual approval but may be used under an appropriate group standard

Hazard Classes and CategoriesSkin Irrit. 2 (29.6%)

Safety data

PPE
Eyeshields, Gloves, type ABEK (EN14387) respirator filter
wgk
3
tsca
TSCA listed
hs_code
29333999
risk_code
36/37/38
Signal word
Warning

Chemistry & industry

Uses & manufacturing

Use ClassificationFragrance Ingredients
General Manufacturing Information2-Pyridinecarboxylic acid, ethyl ester: ACTIVE

Applications

UsesEthyl picolinate is used in the preparation of 2-Aminodihydro[1,3]thiazines as BACE 2 inhibitors which is used in the treatment of diabetes. It is also used as pharmaceutical intermediate.

UsesEthyl picolinate can be used in the preparation of 2-Aminodihydro[1,3]thiazines as BACE 2 inhibitors and their preparation and use in the treatment of diabetes.

Upstream & downstream products

Suppliers100 total

国药集团化学试剂有限公司86-21-63210123 · [email protected]
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
韶远科技（上海）有限公司021-50795510 4000665055 · [email protected]
科瑞迪化学400-821-5857 021-64326257 · [email protected]

Related reactions

62 records
New reaction record

Compound notes

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