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4'-BROMOBENZO-18-CROWN-6

4'-BROMOBENZO-18-CROWN-6 structure

CAS No:
75460-28-5
Formula:
C16H23BrO6
Chemical Name:
4'-BROMOBENZO-18-CROWN-6
Synonyms:
2,3-(4-BROMOBENZO)-1,4,7,10,13,16-HEXAOXACYCLOOCTADEC-2-ENE;4'-BROMOBENZO-18-CROWN-6;4'-BROMOBENZO-18-CROWN 6-ETHER;4-Brombenzo-18-crown-6;4'-BROMOBENZO-18-CROWN-698%;(Benzo-18-crown-6)-4μ-ylbromide;4'-Bromobenzo-18-crown-6,98%;4'-Bromobenzo-18-crown5-Ether
Categories:
Chemical Reagents > Organic Reagents

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Description

white powder

4'-BROMOBENZO-18-CROWN-6 Basic Attributes

Molecular Weight：

391.25

Exact Mass：

390.067780

DSSTox ID：

DTXSID70370186

HScode：

29329900

Characteristics

PSA：

55.4

XLogP3：

1.66

Appearance：

White Powder

Density：

1.3±0.1 g/cm3

Melting Point：

78-80 °C(lit.)

Boiling Point：

490.1±45.0 °C at 760 mmHg

Flash Point：

204.9±27.2 °C

Refractive Index：

1.477

Safety Information

wgk germany：

safety instructions：

22-24/25

Precautionary statement(s)：

P264, P280, P302+P352, P305+P351+P338, P321, P332+P313, P337+P313, P362

Hazard Statements：

H315

GHS Classification：

|Warning|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P264, P280, P302+P352, P305+P351+P338, P321, P332+P313, P337+P313, and P362|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Computed Properties

Molecular Weight:391.25
XLogP3:1
Hydrogen Bond Acceptor Count:6
Exact Mass:390.06780
Monoisotopic Mass:390.06780
Topological Polar Surface Area:55.4
Heavy Atom Count:23
Complexity:294
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes