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1,2,5-Oxadiazole-3-carboxaldehyde,4-methyl-(9CI)

1,2,5-Oxadiazole-3-carboxaldehyde,4-methyl-(9CI) structure

CAS No:
90507-35-0
Formula:
C4H4N2O2
Chemical Name:
1,2,5-Oxadiazole-3-carboxaldehyde,4-methyl-(9CI)
Synonyms:
4-Methyl-1,2,5-oxadiazole-3-carbaldehyde;SCHEMBL6823053;DTXSID40567288;5066AC;MFCD08669943;ZINC20446269;AKOS006230144;SY162027;4-methyl-1,2,5-Oxadiazole-3-carboxaldehyde;CS-0080398

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1,2,5-Oxadiazole-3-carboxaldehyde,4-methyl-(9CI) Basic Attributes

Molecular Weight：

112.087

Exact Mass：

112.027275

DSSTox ID：

DTXSID40567288

HScode：

2934999090

Characteristics

PSA：

55.99000

XLogP3：

1.27

Density：

1.3±0.1 g/cm3

Boiling Point：

201.5±32.0 °C at 760 mmHg

Flash Point：

75.6±25.1 °C

Refractive Index：

1.520

Safety Information

GHS Classification：

|Warning|H227 (50%): Combustible liquid [Warning Flammable liquids]|P210, P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P370+P378, P403+P233, P403+P235, P405, and P501|Aggregated GHS information provided by 2 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:112.09
XLogP3:-0.1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:1
Exact Mass:112.027277375
Monoisotopic Mass:112.027277375
Topological Polar Surface Area:56
Heavy Atom Count:8
Complexity:96
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 1,2,5-Oxadiazole-3-carboxaldehyde,4-methyl-(9CI)

Basic Attributes
Characteristics
Safety Information
Computed Properties

1,2,5-Oxadiazole-3-carboxaldehyde,4-methyl-(9CI)

SDS

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