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5-Iodoquinoline

5-Iodoquinoline structure

CAS No:
1006-50-4
Formula:
C9H6IN
Chemical Name:
5-Iodoquinoline
Synonyms:
Quinoline,5-iodo-;5-Iodoquinoline
Categories:
Pharmaceutical Intermediates > Bulk Drug Intermediates

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5-Iodoquinoline Basic Attributes

Molecular Weight：

255.06

Exact Mass：

255.06

DSSTox ID：

DTXSID80621691

Characteristics

PSA：

12.89000

XLogP3：

2.83940

Density：

1.837

Melting Point：

98-101 °C

Boiling Point：

320.7±15.0 °C(Predicted)

PKA：

3.97±0.12

Safety Information

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, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Computed Properties

Molecular Weight:255.05
XLogP3:2.9
Hydrogen Bond Acceptor Count:1
Exact Mass:254.95450
Monoisotopic Mass:254.95450
Topological Polar Surface Area:12.9
Heavy Atom Count:11
Complexity:138
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes