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ISOXAZOLE,3-METHYL-

ISOXAZOLE,3-METHYL- structure

CAS No:
30842-90-1
Formula:
C4H5NO
Chemical Name:
ISOXAZOLE,3-METHYL-
Synonyms:
ISOXAZOLE, 3-METHYL-;3-Methyl-isoxazole;Isoxazole, 3-methyl- (8ci)(9ci);Nsc 52270;3-Methyl-1,2-oxazole;3-methylisoxazole analogue

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ISOXAZOLE,3-METHYL- Basic Attributes

Molecular Weight：

83.09

Exact Mass：

83.037113783 g/mol

UNII：

P8WZL93LEO

NSC Number：

52270

DSSTox ID：

DTXSID20184856

Characteristics

PSA：

26 Å²

Density：

1.016

Boiling Point：

119℃

Refractive Index：

1.4550 (estimate)

PKA：

-1.39±0.50

Safety Information

Packing level：

III

Hazard category：

3.2

Transport codes：

1993

GHS Classification：

|Warning|H226 (100%): Flammable liquid and vapor [Warning Flammable liquids]|P210, P233, P240, P241, P242, P243, P261, P264, P271, P280, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P370+P378, P403+P233, P403+P235, P405, and P501|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Computed Properties

Molecular Weight:83.09
XLogP3:0.8
Hydrogen Bond Acceptor Count:2
Exact Mass:83.037113783
Monoisotopic Mass:83.037113783
Topological Polar Surface Area:26
Heavy Atom Count:6
Complexity:46.8
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Hot Searches: dinitrogen trioxide formula; copper sulfide compound; 1-bromo-2-methylpropane; magnesium phosphate formula; aluminum carbonate formula; 2-chlorobenzoic acid

Guide of ISOXAZOLE,3-METHYL-

Basic Attributes
Characteristics
Safety Information
Computed Properties

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