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Home > Encyclopedia > 4-Benzylidene-2,6-di-tert-butylcyclohexa-2,5-dienone

4-Benzylidene-2,6-di-tert-butylcyclohexa-2,5-dienone

4-Benzylidene-2,6-di-tert-butylcyclohexa-2,5-dienone structure

4-Benzylidene-2,6-di-tert-butylcyclohexa-2,5-dienone 

structure
  • CAS No:

    7078-98-0

  • Formula:

    C21H26O

  • Chemical Name:

    4-Benzylidene-2,6-di-tert-butylcyclohexa-2,5-dienone

  • Synonyms:

    2,5-Cyclohexadien-1-one,2,6-bis(1,1-dimethylethyl)-4-(phenylmethylene)-;2,5-Cyclohexadien-1-one,4-benzylidene-2,6-di-tert-butyl-;2,6-Bis(1,1-dimethylethyl)-4-(phenylmethylene)-2,5-cyclohexadien-1-one;4-Benzylidene-2,6-di-tert-butyl-2,5-cyclohexadien-1-one;4-Benzylidene-2,6-di-tert-butylcyclohexa-2,5-dienone;2,6-Di-tert-butyl-4-benzylidene-cyclohexa-2,5-dienone

  • Categories:

    Organic Chemistry  >  Coordination Complexes

4-Benzylidene-2,6-di-tert-butylcyclohexa-2,5-dienone Basic Attributes

294.44

294.43

429-460-4

DTXSID6052453

Characteristics

17.07000

5.59770

1.03 g/cm3

74-75 °C

186 °C @ Press: 1 Torr

183ºC

1.571

Safety Information

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

H317

|Warning|H317: May cause an allergic skin reaction [Warning Sensitization, Skin]|P261, P272, P273, P280, P302+P352, P321, P333+P313, P363, and P501|H317 (100%): May cause an allergic skin reaction [Warning Sensitization, Skin]|Aggregated GHS information provided by 15 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.|Aggregated GHS information provided by 95 companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

4-Benzylidene-2,6-di-tert-butylcyclohexa-2,5-dienone Use and Manufacturing

Uses

Polymerization Inhibitor

Production

500,000 - 1,000,000 lb

Petroleum refineries|2,5-Cyclohexadien-1-one, 2,6-bis(1,1-dimethylethyl)-4-(phenylmethylene)-: ACTIVE|PMN - indicates a commenced PMN (Pre-Manufacture Notices) substance.

Computed Properties

Molecular Weight:294.4
XLogP3:6.1
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:3
Exact Mass:294.198365449
Monoisotopic Mass:294.198365449
Topological Polar Surface Area:17.1
Heavy Atom Count:22
Complexity:487
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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