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Home> Hot Product Listed O   > o-hexadecylphenol
84012-44-2 structure

o-hexadecylphenol

CAS No.:84012-44-2
Molecular Weight:192.2527
Molecular Formula:C5H12O (isomer)
Names and Identifiers
Synonyms

2-HEXADECYL-PHENOL

Inchi
InChI=1S/C9H20O4/c1-2-3-5-11-7-8-13-9-12-6-4-10/h10H,2-9H2,1H3
Canonical Smiles
CCCCOCCOCOCCO
Properties
Density
1.143
Boiling Point
658.2°C at 760 mmHg
Flash Point
385.7°C
Reach Info
Globally, no enterprise has officially registered the substance REACH.
Other official information: ·ECHA Information Page for CAS: 84012-44-2 EC: o-hexadecylphenol ·ECHA C&L Inventory for CAS: CAS: 84012-44-2 EC: o-hexadecylphenol
Computational chemical data
  • Molecular Weight:192.2527g/mol
  • Molecular Formula:C5H12O
  • XLogP3-AA:0.5
  • Exact Mass:192.136159
  • Monoisotopic Mass:192.136159
  • Complexity:87.7
  • Rotatable Bond Count:10
  • Hydrogen Bond Donor Count:1
  • Hydrogen Bond Acceptor Count:4
  • Topological Polar Surface Area:47.9
  • Heavy Atom Count:13
  • Defined Atom Stereocenter Count:0
  • Undefined Atom Stereocenter Count:0
  • Defined Bond Stereocenter Count:0
  • Undefined Bond Stereocenter Count:0
  • Isotope Atom Count:0
  • Covalently-Bonded Unit Count:1
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  • Fax:
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  • Tel:203-822-9800
  • Fax:203-822-9820
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