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2,2-Difluoro-1,3-benzodioxole-4-carboxaldehyde

2,2-Difluoro-1,3-benzodioxole-4-carboxaldehyde structure

CAS No:
119895-68-0
Formula:
C8H4F2O3
Chemical Name:
2,2-Difluoro-1,3-benzodioxole-4-carboxaldehyde
Synonyms:
1,3-Benzodioxole-4-carboxaldehyde,2,2-difluoro-;2,2-Difluoro-1,3-benzodioxole-4-carboxaldehyde;2,2-Difluoro-4-formylbenzodioxole;2,2-Difluorobenzodioxole-4-carboxaldehyde;2,2-Difluoro-1,3-benzodioxol-4-aldehyde;2,2-Difluorobenz[1,3]dioxol-4-carboxaldehyde;2,2-Difluoro-2H-1,3-benzodioxole-4-carbaldehyde;2,2-Difluoro-1,3-dioxaindane-4-carbaldehyde
Categories:
Pharmaceutical Intermediates > Bulk Drug Intermediates

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2,2-Difluoro-1,3-benzodioxole-4-carboxaldehyde Basic Attributes

Molecular Weight：

186.11200

Exact Mass：

186.11

EC Number：

700-476-6

DSSTox ID：

DTXSID90371736

HScode：

2932999099

Characteristics

PSA：

35.53000

XLogP3：

1.82060

Density：

1.5 g/cm3

Boiling Point：

99-101 °C @ Press: 14 Torr

Flash Point：

79.2ºC

Refractive Index：

1.4955

Vapor Pressure：

0.108mmHg at 25°C

Safety Information

hazard class code：

R36/37/38

safety instructions：

26-36

Marks：

GHS Classification：

|Warning|H315 (21.89%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P272, P273, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P333+P313, P337+P313, P362, P363, P391, P403+P233, P405, and P501|Aggregated GHS information provided by 201 companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:186.11
XLogP3:2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:1
Exact Mass:186.01285031
Monoisotopic Mass:186.01285031
Topological Polar Surface Area:35.5
Heavy Atom Count:13
Complexity:219
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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CAS No.: 119895-68-0

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Guide of 2,2-Difluoro-1,3-benzodioxole-4-carboxaldehyde

Basic Attributes
Characteristics
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Computed Properties
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