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5-(1,1-Dimethylethyl)-1,3-benzodioxole

5-(1,1-Dimethylethyl)-1,3-benzodioxole structure

CAS No:
7228-36-6
Formula:
C11H14O2
Chemical Name:
5-(1,1-Dimethylethyl)-1,3-benzodioxole
Synonyms:
1,3-Benzodioxole,5-(1,1-dimethylethyl)-;Benzene,4-tert-butyl-1,2-(methylenedioxy)-;5-(1,1-Dimethylethyl)-1,3-benzodioxole;5-tert-Butyl-1,3-benzodioxole;5-tert-Butylbenzo[d][1,3]dioxole;126236-11-1

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5-(1,1-Dimethylethyl)-1,3-benzodioxole Basic Attributes

Molecular Weight：

178.231

Exact Mass：

178.23

DSSTox ID：

DTXSID60222605

Characteristics

PSA：

18.5

XLogP3：

3.6

Density：

1.047 g/mL at 25 °C(lit.)

Boiling Point：

65-70 °C

Drug Information

MeSH Entry Terms：

5-TBBD

Computed Properties

Molecular Weight:178.23
XLogP3:3.6
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:1
Exact Mass:178.099379685
Monoisotopic Mass:178.099379685
Topological Polar Surface Area:18.5
Heavy Atom Count:13
Complexity:183
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 5-(1,1-Dimethylethyl)-1,3-benzodioxole

Basic Attributes
Characteristics
Drug Information
Computed Properties

5-(1,1-Dimethylethyl)-1,3-benzodioxole

SDS

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