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4-Aminoisoxazole

4-Aminoisoxazole structure

CAS No:
108511-97-3
Formula:
C3H4N2O
Chemical Name:
4-Aminoisoxazole
Synonyms:
4-Aminoisoxazole;Isoxazol-4-ylamine;1,2-oxazol-4-aMine

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4-Aminoisoxazole Basic Attributes

Molecular Weight：

84.08

Exact Mass：

84.032362755

DSSTox ID：

DTXSID30549977

Characteristics

Density：

1.241±0.06 g/cm3

Melting Point：

130-135 °C (decomp)

Boiling Point：

234.7±13.0 °C(Predicted)

PKA：

1.88±0.10

Safety Information

GHS Classification：

|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P264, P270, P301+P312, P330, and P501|Aggregated GHS information provided by 40 companies from 2 notifications to the ECHA C&L Inventory.

Computed Properties

Molecular Weight:84.08
XLogP3:-0.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Exact Mass:84.032362755
Monoisotopic Mass:84.032362755
Topological Polar Surface Area:52
Heavy Atom Count:6
Complexity:48.1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 4-Aminoisoxazole

Basic Attributes
Characteristics
Safety Information
Computed Properties

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