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3-(2-Chloro-4-nitrophenyl)-5-(1,1-dimethylethyl)-1,3,4-oxadiazol-2(3H)-one

3-(2-Chloro-4-nitrophenyl)-5-(1,1-dimethylethyl)-1,3,4-oxadiazol-2(3H)-one structure

CAS No:
31399-83-4
Formula:
C12H12ClN3O4
Chemical Name:
3-(2-Chloro-4-nitrophenyl)-5-(1,1-dimethylethyl)-1,3,4-oxadiazol-2(3H)-one
Synonyms:
1,3,4-Oxadiazol-2(3H)-one,3-(2-chloro-4-nitrophenyl)-5-(1,1-dimethylethyl)-;Δ2-1,3,4-Oxadiazolin-5-one,2-tert-butyl-4-(2-chloro-4-nitrophenyl)-;3-(2-Chloro-4-nitrophenyl)-5-(1,1-dimethylethyl)-1,3,4-oxadiazol-2(3H)-one

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3-(2-Chloro-4-nitrophenyl)-5-(1,1-dimethylethyl)-1,3,4-oxadiazol-2(3H)-one Basic Attributes

Molecular Weight：

297.69438

Exact Mass：

297.69

EC Number：

250-613-4

UNII：

T69GC7MMS7

DSSTox ID：

DTXSID10185317

HScode：

2934999090

Characteristics

PSA：

87.7

XLogP3：

3.2

Density：

1.44g/cm3

Boiling Point：

389.3ºC at 760mmHg

Flash Point：

189.2ºC

Refractive Index：

1.62

Computed Properties

Molecular Weight:297.69
XLogP3:3.2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:2
Exact Mass:297.0516336
Monoisotopic Mass:297.0516336
Topological Polar Surface Area:87.7
Heavy Atom Count:20
Complexity:455
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 3-(2-Chloro-4-nitrophenyl)-5-(1,1-dimethylethyl)-1,3,4-oxadiazol-2(3H)-one

Basic Attributes
Characteristics
Computed Properties

3-(2-Chloro-4-nitrophenyl)-5-(1,1-dimethylethyl)-1,3,4-oxadiazol-2(3H)-one

SDS

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