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5-(Chloromethyl)-6-propyl-1,3-benzodioxole

5-(Chloromethyl)-6-propyl-1,3-benzodioxole structure

CAS No:
1938-32-5
Formula:
C11H13ClO2
Chemical Name:
5-(Chloromethyl)-6-propyl-1,3-benzodioxole
Synonyms:
1,3-Benzodioxole,5-(chloromethyl)-6-propyl-;Toluene,α-chloro-4,5-(methylenedioxy)-2-propyl-;5-(Chloromethyl)-6-propyl-1,3-benzodioxole

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5-(Chloromethyl)-6-propyl-1,3-benzodioxole Basic Attributes

Molecular Weight：

212.67300

Exact Mass：

212.67

EC Number：

217-715-0

DSSTox ID：

DTXSID8062070

Characteristics

PSA：

18.46000

XLogP3：

3.10660

Density：

1.197g/cm3

Boiling Point：

155-165 °C @ Press: 10 Torr

Flash Point：

112.5ºC

Refractive Index：

1.547

Vapor Pressure：

0.00243mmHg at 25°C

Drug Information

MeSH Entry Terms：

5-chloromethyl-6-propyl-1,3-benzodioxole

5-(Chloromethyl)-6-propyl-1,3-benzodioxole Use and Manufacturing

Manufacturing Info：

1,3-Benzodioxole, 5-(chloromethyl)-6-propyl-: INACTIVE

Computed Properties

Molecular Weight:212.67
XLogP3:3.5
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:3
Exact Mass:212.0604073
Monoisotopic Mass:212.0604073
Topological Polar Surface Area:18.5
Heavy Atom Count:14
Complexity:186
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 5-(Chloromethyl)-6-propyl-1,3-benzodioxole

Basic Attributes
Characteristics
Drug Information
Use and Manufacturing
Computed Properties

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