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5-(Chloromethyl)-3-[4-(1,1-dimethylethyl)phenyl]-1,2,4-oxadiazole

5-(Chloromethyl)-3-[4-(1,1-dimethylethyl)phenyl]-1,2,4-oxadiazole structure

CAS No:
175204-40-7
Formula:
C13H15ClN2O
Chemical Name:
5-(Chloromethyl)-3-[4-(1,1-dimethylethyl)phenyl]-1,2,4-oxadiazole
Synonyms:
1,2,4-Oxadiazole,5-(chloromethyl)-3-[4-(1,1-dimethylethyl)phenyl]-;5-(Chloromethyl)-3-[4-(1,1-dimethylethyl)phenyl]-1,2,4-oxadiazole;3-(4-tert-Butylphenyl)-5-chloromethyl-1,2,4-oxadiazole

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5-(Chloromethyl)-3-[4-(1,1-dimethylethyl)phenyl]-1,2,4-oxadiazole Basic Attributes

Molecular Weight：

250.72400

Exact Mass：

250.72

DSSTox ID：

DTXSID90381835

HScode：

2934999090

Characteristics

PSA：

38.92000

XLogP3：

3.77290

Density：

1.148g/cm3

Melting Point：

46ºC

Boiling Point：

350.2ºC at 760mmHg

Flash Point：

165.6ºC

Refractive Index：

1.53

Vapor Pressure：

9E-05mmHg at 25°C

Safety Information

hazard class code：

R36/37/38

safety instructions：

S26; S36/37/39

Marks：

Computed Properties

Molecular Weight:250.72
XLogP3:4.1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:250.0872908
Monoisotopic Mass:250.0872908
Topological Polar Surface Area:38.9
Heavy Atom Count:17
Complexity:246
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 5-(Chloromethyl)-3-[4-(1,1-dimethylethyl)phenyl]-1,2,4-oxadiazole

Basic Attributes
Characteristics
Safety Information
Computed Properties

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