Ethyl 2-Methyloxazole-4-carboxylate - CAS 10200-43-8

Catalog:	BB000733
Product Name:	Ethyl 2-Methyloxazole-4-carboxylate
CAS:	10200-43-8
Synonyms:	2-methyl-4-oxazolecarboxylic acid ethyl ester; ethyl 2-methyl-1,3-oxazole-4-carboxylate

Technical Data

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Computed Properties

IUPAC Name:	ethyl 2-methyl-1,3-oxazole-4-carboxylate
Description:	Ethyl 2-Methyloxazole-4-carboxylate (CAS# 10200-43-8) is a useful research chemical.
Molecular Weight:	155.15
Molecular Formula:	C7H9NO3
Canonical SMILES:	CCOC(=O)C1=COC(=N1)C
InChI:	InChI=1S/C7H9NO3/c1-3-10-7(9)6-4-11-5(2)8-6/h4H,3H2,1-2H3
InChI Key:	JRPMRQTZCURBRG-UHFFFAOYSA-N
Boiling Point:	210.361 °C at 760 mmHg
Density:	1.14 g/cm³
Appearance:	Solid
Storage:	Sealed in dry, Room Temperature
MDL:	MFCD07367959
LogP:	1.15970

Publication Number	Title	Priority Date
WO-2021127643-A1	Fluoroalkyl-oxadiazoles and uses thereof	20191220
US-2020123117-A1	Androgen receptor modulators and methods for their use	20181018
WO-2020081999-A1	Androgen receptor modulators and methods for their use	20181018
US-2020247763-A1	Androgen receptor modulators and methods for their use	20181018
CN-113195441-A	Androgen receptor modulators and methods of use thereof	20181018

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Carbonyl Compounds

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GHS Hazard Statement:	H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
Precautionary Statement:	P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501
Signal Word:	Warning

Complexity:	149
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	155.058243149
Formal Charge:	0
Heavy Atom Count:	11
Hydrogen Bond Acceptor Count:	4
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	155.058243149
Rotatable Bond Count:	3
Topological Polar Surface Area:	52.3 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.3