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1-azido-4-iodobenzene

1-azido-4-iodobenzene structure

CAS No:
53694-87-4
Formula:
C6H4IN3
Chemical Name:
1-azido-4-iodobenzene
Synonyms:
1-azido-4-iodobenzene;1-Azido-4-iodobenzene solution;4-Iodophenyl azide solution;1-Azido-4-iodobenzene solution 0.5 M in tert-butyl methyl ether, >=95% (HPLC)
Categories:
Organic Chemistry > Azides

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1-azido-4-iodobenzene Basic Attributes

Molecular Weight：

245.023

Exact Mass：

244.945

DSSTox ID：

DTXSID20201951

Characteristics

PSA：

14.4

XLogP3：

3.2

Flash Point：

-33℃

Storage Conditions：

-20°C

Safety Information

Transport codes：

UN 2398 3 / PGII

wgk germany：

hazard class code：

11-38-48/23/24/25

safety instructions：

Marks：

F,T

Precautionary statement(s)：

P210, P220, P234, P260, P261, P264, P270, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P314, P321, P332+P313, P337+P313, P362, P370+P378, P370+P380+P375, P403+P233, P403+P235, P405, P411, P420, P501

Hazard Statements：

H315

GHS Classification：

|Danger|H241 (97.44%): Heating may cause a fire or explosion [Danger Self-reactive substances and mixtures; Organic peroxides]|P210, P220, P234, P260, P261, P264, P270, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P314, P321, P332+P313, P337+P313, P362, P370+P378, P370+P380+P375, P403+P233, P403+P235, P405, P411, P420, and P501|Aggregated GHS information provided by 39 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Drug Information

MeSH Entry Terms：

1-azido-4-iodobenzene

Computed Properties

Molecular Weight:245.02
XLogP3:3.2
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:1
Exact Mass:244.94499
Monoisotopic Mass:244.94499
Topological Polar Surface Area:14.4
Heavy Atom Count:10
Complexity:145
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes