Structure Database (LMSD)

Common Name
15-methylhexadecanol
Systematic Name
15-methylhexadecan-1-ol
Synonyms
  • Isoheptadecanol
LM ID
LMFA05000781
Formula
Exact Mass
Calculate m/z
256.276616
Sum Composition
Status
Curated

Classification

Category
Main Class
Sub Class

References

Taxonomy Information

Curated from
NCBI taxonomy class
Reference
Hystrix cristata (#10137)
Mammalia (#40674)
Sexual and individual cues in the peri-anal gland secretum of crested porcupines (Hystrix cristata),
Mamm Biol, 2009

String Representations

InChiKey (Click to copy)
VWIXGTHYBZXAPS-UHFFFAOYSA-N
InChi (Click to copy)
InChI=1S/C17H36O/c1-17(2)15-13-11-9-7-5-3-4-6-8-10-12-14-16-18/h17-18H,3-16H2,1-2H3
SMILES (Click to copy)
C(CCCCCCCCCCCCCC(C)C)O

Other Databases

CHEBI ID
PubChem CID

Calculated Physicochemical Properties

Heavy Atoms 18
Rings
Aromatic Rings
Rotatable Bonds 14
Van der Waals Molecular Volume 311.45
Topological Polar Surface Area 20.23
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 1
logP 5.99
Molar Refractivity 82.43

Admin

Created at
9th Jul 2025
Updated at
9th Jul 2025