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Isoxazole-3-carbaldehyde

Isoxazole-3-carbaldehyde structure

CAS No:
89180-61-0
Formula:
C4H3NO2
Chemical Name:
Isoxazole-3-carbaldehyde
Synonyms:
ISOXAZOLE-3-CARBALDEHYDE;3-ISOXAZOLECARBOXALDEHYDE;isoxazole-3-carbaldehyde(SALTDATA: FREE);1,2-Oxazole-3-carbaldehyde;isoxazole-3-carboxaldehyde

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Isoxazole-3-carbaldehyde Basic Attributes

Molecular Weight：

97.07

Exact Mass：

97.016378338

DSSTox ID：

DTXSID70593212

Characteristics

Density：

1.258±0.06 g/cm3

Boiling Point：

60 °C(Press: 40 Torr)

PKA：

-5.25±0.50

Safety Information

hazard class code：

22-36-43

safety instructions：

26-36/37

Marks：

GHS Classification：

|Warning|H227 (100%): Combustible liquid [Warning Flammable liquids]|P210, P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, 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:97.07
XLogP3:0.2
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:97.016378338
Monoisotopic Mass:97.016378338
Topological Polar Surface Area:43.1
Heavy Atom Count:7
Complexity:74.1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Hot Searches: soda ash na2co3; cyclobutane; hexanoic acid; nitrate formula; lead oxide; 2 pentanol

Guide of Isoxazole-3-carbaldehyde

Basic Attributes
Characteristics
Safety Information
Computed Properties

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