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2-Methyl-5-nitrobenzoxazole

2-Methyl-5-nitrobenzoxazole structure

CAS No:
32046-51-8
Formula:
C8H6N2O3
Chemical Name:
2-Methyl-5-nitrobenzoxazole
Synonyms:
Benzoxazole,2-methyl-5-nitro-;2-Methyl-5-nitrobenzoxazole;2-Methyl-5-nitro-1,3-benzoxazole;2-Methyl-5-nitro-benzooxazole

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2-Methyl-5-nitrobenzoxazole Basic Attributes

Molecular Weight：

178.14

Exact Mass：

178.14

EC Number：

250-904-6

DSSTox ID：

DTXSID60185862

Characteristics

PSA：

71.8 Å²

Density：

1.395±0.06 g/cm3

Melting Point：

154.7-155.5 °C

Boiling Point：

303.1±15.0 °C(Predicted)

PKA：

-5.28±0.10

Safety Information

Hazard category：

IRRITANT

GHS Classification：

|Danger|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P310, P312, P321, P330, P332+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:178.14
XLogP3:2
Hydrogen Bond Acceptor Count:4
Exact Mass:178.03784206
Monoisotopic Mass:178.03784206
Topological Polar Surface Area:71.8
Heavy Atom Count:13
Complexity:216
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2-Methyl-5-nitrobenzoxazole

Basic Attributes
Characteristics
Safety Information
Computed Properties

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