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Home > Encyclopedia > 5-methyl-1-phenylhexan-1-one

5-methyl-1-phenylhexan-1-one

5-methyl-1-phenylhexan-1-one structure

5-methyl-1-phenylhexan-1-one 

structure
  • CAS No:

    25552-17-4

  • Formula:

    C13H18O

  • Chemical Name:

    5-methyl-1-phenylhexan-1-one

  • Synonyms:

    5-methyl-1-phenylhexan-1-one;1-Phenyl-5-methyl-1-hexanone;25552-17-4;Hexanophenone, 5-methyl-;1-Hexanone, 5-methyl-1-phenyl-;Isoheptanophenone;4-ISOPROPYLBUTYROPHENONE;SCHEMBL6604832;DTXSID40948452;5-Methyl-1-phenyl-1-hexanone #;ZINC37117010;AKOS008127813;MCULE-9879541702;NE26510;5-methyl-1-phenylhexan-1-one, AldrichCPR;EN300-55201

5-methyl-1-phenylhexan-1-one Basic Attributes

190.28 g/mol

190.135765193 g/mol

Characteristics

17.1 Ų

Safety Information

|Warning|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Computed Properties

Molecular Weight:190.28
XLogP3:3.8
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:5
Exact Mass:190.135765193
Monoisotopic Mass:190.135765193
Topological Polar Surface Area:17.1
Heavy Atom Count:14
Complexity:166
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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