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5-Isoxazolecarboxylicacid,3-methyl-,ethylester(6CI,7CI,9CI)

5-Isoxazolecarboxylicacid,3-methyl-,ethylester(6CI,7CI,9CI) structure

CAS No:
63366-79-0
Formula:
C7H9NO3
Chemical Name:
5-Isoxazolecarboxylicacid,3-methyl-,ethylester(6CI,7CI,9CI)
Synonyms:
5-Isoxazolecarboxylicacid,3-methyl-,ethylester(6CI,7CI,9CI);5-Isoxazolecarboxylicacid, 3-methyl-, ethyl ester;3-Methyl-5-Isoxazolecarboxylic acid, ethyl ester;3-methylisoxazole-5-carboxylic acid ethyl ester;ethyl 3-methyl-1,2-oxazole-5-carboxylate

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5-Isoxazolecarboxylicacid,3-methyl-,ethylester(6CI,7CI,9CI) Basic Attributes

Molecular Weight：

155.15

Exact Mass：

155.058243149

DSSTox ID：

DTXSID70438119

Characteristics

Density：

1.139±0.06 g/cm3

Melting Point：

27-28℃

Boiling Point：

243.3±20.0 °C(Predicted)

PKA：

-3.24±0.50

Safety Information

Hazard category：

IRRITANT

GHS Classification：

|Warning|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Computed Properties

Molecular Weight:155.15
XLogP3:1.3
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:3
Exact Mass:155.058243149
Monoisotopic Mass:155.058243149
Topological Polar Surface Area:52.3
Heavy Atom Count:11
Complexity:149
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 5-Isoxazolecarboxylicacid,3-methyl-,ethylester(6CI,7CI,9CI)

Basic Attributes
Characteristics
Safety Information
Computed Properties

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