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5-(4-methylphenyl)-1,2-oxazole-3-carbaldehyde

5-(4-methylphenyl)-1,2-oxazole-3-carbaldehyde structure

CAS No:
640292-02-0
Formula:
C11H9NO2
Chemical Name:
5-(4-methylphenyl)-1,2-oxazole-3-carbaldehyde
Synonyms:
3-Isoxazolecarboxaldehyde,5-(4-methylphenyl); 5-(p-tolyl)isoxazole-3-carbaldehyde; 5-(4-methylphenyl)-isoxazole-3-carboxaldehyde;

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5-(4-methylphenyl)-1,2-oxazole-3-carbaldehyde Basic Attributes

Molecular Weight：

187.19500

Exact Mass：

187.063328530

DSSTox ID：

DTXSID80584575

HScode：

2934999090

Characteristics

PSA：

43.10000

XLogP3：

2.46250

Density：

1.179g/cm3

Melting Point：

69-73ºC(lit.)

Boiling Point：

366.7ºC at 760 mmHg

Flash Point：

175.6ºC

Refractive Index：

1.58

Safety Information

Marks：

GHS Classification：

|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 38 companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:187.19
XLogP3:2.7
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:187.063328530
Monoisotopic Mass:187.063328530
Topological Polar Surface Area:43.1
Heavy Atom Count:14
Complexity:200
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 5-(4-methylphenyl)-1,2-oxazole-3-carbaldehyde

Basic Attributes
Characteristics
Safety Information
Computed Properties

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