1731-92-6
Product Name:
METHYL HEPTADECANOATE
Formula:
C18H36O2
Synonyms:
Heptadecanoic acid methyl ester;Methyl heptadecanate;Methyl margarate
Inquiry
CHEMICAL AND PHYSICAL PROPERTIES
Physical Description | Off-white powder; mp = 29.8-30.3 deg C; [Sigma-Aldrich MSDS] |
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Kovats Retention Index | 2009 2008 2008 2010 2001.9 2003.1 2004.2 2005.5 2006.7 2008 2009.3 2010 2014 2007 2011 2013 2013 2009 2006 2008 2009 2007 2005 2007 2011.9 2011.7 2007.4 336.74 347 347.1 |
Chemical Classes | Other Classes -> Esters, Other |
SAFETY INFORMATION
Signal word | Warning |
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Pictogram(s) |
Exclamation Mark Irritant GHS07 |
GHS Hazard Statements |
H302:Acute toxicity,oral H315:Skin corrosion/irritation H319:Serious eye damage/eye irritation H335:Specific target organ toxicity, single exposure;Respiratory tract irritation |
Precautionary Statement Codes |
P261:Avoid breathing dust/fume/gas/mist/vapours/spray. P305+P351+P338:IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing. |
COMPUTED DESCRIPTORS
Molecular Weight | 284.5 g/mol |
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XLogP3 | 8.5 |
Hydrogen Bond Donor Count | 0 |
Hydrogen Bond Acceptor Count | 2 |
Rotatable Bond Count | 16 |
Exact Mass | 284.271530387 g/mol |
Monoisotopic Mass | 284.271530387 g/mol |
Topological Polar Surface Area | 26.3 Ų |
Heavy Atom Count | 20 |
Formal Charge | 0 |
Complexity | 202 |
Isotope Atom Count | 0 |
Defined Atom Stereocenter Count | 0 |
Undefined Atom Stereocenter Count | 0 |
Defined Bond Stereocenter Count | 0 |
Undefined Bond Stereocenter Count | 0 |
Covalently-Bonded Unit Count | 1 |
Compound Is Canonicalized | Yes |
PRODUCT INTRODUCTION
description
Methyl heptadecanoate is a fatty acid methyl ester.