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Isomethylpseudoionone

Isomethylpseudoionone structure

Isomethylpseudoionone 

structure
  • CAS No:

    1117-41-5

  • Formula:

    C14H22O

  • Chemical Name:

    Isomethylpseudoionone

  • Synonyms:

    3,5,9-Undecatrien-2-one,3,6,10-trimethyl-;Pseudoionone,isomethyl-;3,6,10-Trimethyl-3,5,9-undecatrien-2-one;Methylisopseudoionone;Isomethylpseudoionone;5659-78-9

Isomethylpseudoionone Basic Attributes

206.329

206.32

214-245-8

DTXSID0051576

Characteristics

17.1

4.3

115-118 °C @ Press: 5 Torr

Safety Information

P261, P264, P272, P273, P280, P302+P352, P305+P351+P338, P321, P332+P313, P333+P313, P337+P313, P362, P363, P391, P501

H315

|Warning|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P272, P273, P280, P302+P352, P305+P351+P338, P321, P332+P313, P333+P313, P337+P313, P362, P363, P391, and P501|Aggregated GHS information provided by 346 companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Isomethylpseudoionone Use and Manufacturing

3,5,9-Undecatrien-2-one, 3,6,10-trimethyl-: ACTIVE

Computed Properties

Molecular Weight:206.32
XLogP3:4.3
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:5
Exact Mass:206.167065321
Monoisotopic Mass:206.167065321
Topological Polar Surface Area:17.1
Heavy Atom Count:15
Complexity:299
Undefined Bond Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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