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Home > Encyclopedia > 1,4-Diphenoxybutane

1,4-Diphenoxybutane

1,4-Diphenoxybutane structure

1,4-Diphenoxybutane 

structure
  • CAS No:

    3459-88-9

  • Formula:

    C16H18O2

  • Chemical Name:

    1,4-Diphenoxybutane

  • Synonyms:

    1,4-Diphenoxybutane;4-phenoxybutoxybenzene;CHEMBL562547;Benzene, 1,1"-(1,4-butanediylbis(oxy))bis-;Benzene, 1,1"-[1,4-butanediylbis(oxy)]bis-;NSC99254;PubChem2390;1,4-bis-phenoxybutane;1,4-Diphenoxy-n-butane;SCHEMBL1490164

  • Categories:

    Pharmaceutical Intermediates  >  Bulk Drug Intermediates

Description

Off-white Crystals

1,4-Diphenoxybutane Basic Attributes

242.316

242.130676

99254

DTXSID60188151

2909309090

Characteristics

18.5

4.70

1.0±0.1 g/cm3

97-100°C

378.1±25.0 °C at 760 mmHg

149.9±22.7 °C

1.544

Safety Information

P261, P272, P273, P280, P302+P352, P321, P333+P313, P363, P391, P501

H317

|Warning|H317 (100%): May cause an allergic skin reaction [Warning Sensitization, Skin]|P261, P272, P273, P280, P302+P352, P321, P333+P313, P363, P391, and P501|Aggregated GHS information provided by 38 companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:242.31
XLogP3:4.3
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:7
Exact Mass:242.130679813
Monoisotopic Mass:242.130679813
Topological Polar Surface Area:18.5
Heavy Atom Count:18
Complexity:171
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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