9-Octadecenoic acid, 12-hydroxy- methyl ester

9-Octadecenoic acid, 12-hydroxy- methyl ester
Compound Structure:
Synonyms: methyl (E)-12-hydroxyoctadec-9-enoat;12-Hydroxy-9-octadecenoic acid methyl ester;methyl 12-hydroxyoctadec-9-enoate;METHYLRICINELAIDATE;23224-20-6;67529-83-3;9-Octadecenoic acid, 12-hydroxy-, methyl ester, (9E,12R)-
Compound ID: NMPC-533
PubChem ID:

6032867
Molecular Formula: C19H36O3
Canonical SMILES: CCCCCCC(CC=CCCCCCCCC(=O)OC)O
InChIKey: XKGDWZQXVZSXAO-JLHYYAGUSA-N
About the compound:

GHS Hazard Statements

Not Classified

Reported as not meeting GHS hazard criteria by 137 of 137 companies. For more detailed information, please visit ECHA C&L website.
Properties:

Chemical and Physical Properties

Property Name

Property Value

Molecular Weight

312.5 g/mol

XLogP3-AA

6.1

Hydrogen Bond Donor Count

1

Hydrogen Bond Acceptor Count

3

Rotatable Bond Count

16

Exact Mass

312.26644501 g/mol

Monoisotopic Mass

312.26644501 g/mol

Topological Polar Surface Area

46.5Ų

Heavy Atom Count

22

Formal Charge

0

Complexity

274

Isotope Atom Count

0

Defined Atom Stereocenter Count

0

Undefined Atom Stereocenter Count

1

Defined Bond Stereocenter Count

1

Undefined Bond Stereocenter Count

0

Covalently-Bonded Unit Count

1

Compound Is Canonicalized

Yes

Physical Description

Liquid

Boiling Point

BP: 245 °C at 10 mm Hg

Melting Point

Freezing point: -4.5 °C

Density

0.9236 at 22 °C/4 °C

Solubility 

Soluble in alcohol, ether

Source: PubChem
Source Species: Azanza garckeana
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