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5-Bromoquinoline

5-Bromoquinoline structure

CAS No:
4964-71-0
Formula:
C9H6BrN
Chemical Name:
5-Bromoquinoline
Synonyms:
5-bronoquinoline;5-BROMOQUINOLINE;5-bromooquinoline;RARECHEMAKML0010;Quinoline,5-bromo-;5-Bromoquinoline97%;5-Bromoquinoline,97%
Categories:
Pharmaceutical Intermediates > Heterocyclic Compound

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Description

White solid

5-Bromoquinoline Basic Attributes

Molecular Weight：

208.05

Exact Mass：

206.968353

BRN：

115148

DSSTox ID：

DTXSID10355790

HScode：

29334900

Characteristics

PSA：

12.9

XLogP3：

3.3

Density：

1.6±0.1 g/cm3

Melting Point：

50-52°C

Boiling Point：

105-107°C1mm

Flash Point：

105-107°C/1mm

Refractive Index：

1.674

Safety Information

Transport codes：

NONH for all modes of transport

wgk germany：

hazard class code：

36/37/38-20/21/22-22

safety instructions：

26-36

Marks：

Xi,Xn

Hazard note：

Irritant

Precautionary statement(s)：

P261-P280-P305 + P351 + P338

Hazard Statements：

H302-H315-H318-H335

GHS Classification：

|Danger|H302 (87.23%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P310, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 47 companies from 7 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:208.05
XLogP3:3.3
Hydrogen Bond Acceptor Count:1
Exact Mass:206.96836
Monoisotopic Mass:206.96836
Topological Polar Surface Area:12.9
Heavy Atom Count:11
Complexity:138
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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