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3,4-Dihydro-2H-1,5-benzodioxepin-7-amine

3,4-Dihydro-2H-1,5-benzodioxepin-7-amine structure

CAS No:
175136-34-2
Formula:
C9H11NO2
Chemical Name:
3,4-Dihydro-2H-1,5-benzodioxepin-7-amine
Synonyms:
2H-1,5-Benzodioxepin-7-amine,3,4-dihydro-;3,4-Dihydro-2H-1,5-benzodioxepin-7-amine;7-Aminobenzo[b][1,4]dioxepane

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3,4-Dihydro-2H-1,5-benzodioxepin-7-amine Basic Attributes

Molecular Weight：

165.18900

Exact Mass：

165.19

DSSTox ID：

DTXSID50379637

HScode：

2932999099

Characteristics

PSA：

44.48000

XLogP3：

2.01130

Density：

1.193g/cm3

Melting Point：

68 °C

Boiling Point：

123-128ºC/0.2mm

Refractive Index：

1.577

Vapor Pressure：

0.000728mmHg at 25°C

Safety Information

hazard class code：

R36/37/38

safety instructions：

S26

Marks：

GHS Classification：

|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, P403+P233, P405, and P501|Aggregated GHS information provided by 5 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:165.19
XLogP3:1.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Exact Mass:165.078978594
Monoisotopic Mass:165.078978594
Topological Polar Surface Area:44.5
Heavy Atom Count:12
Complexity:152
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 3,4-Dihydro-2H-1,5-benzodioxepin-7-amine

Basic Attributes
Characteristics
Safety Information
Computed Properties

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