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1-Pentadecanol

CAT: 0931-TN6960-03Size: 5 gDry Ice: NoHazardous: No
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CAT#:0931-TN6960-03Size:5 g
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
629-76-5
Target
Others
Related Pathways
Others
Purity
0.9973
Bioactivity
1-Pentadecanol is a natural product with anti-acne activity.
Smiles
C(CCCCCCCO)CCCCCCC
Molecular Formula
C15H32O
Molecular Weight
228.41
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

1-Pentadecanol

Pentadecan-1-ol is a long-chain fatty alcohol that is pentadecane in which one of the terminal methyl hydrogens is replaced by a hydroxy group. It is a pentadecanol and a long-chain primary fatty alcohol.

CAS Number629-76-5
PubChem CID12397
IUPAC Namepentadecan-1-ol
Molecular FormulaC15H32O
Molecular Weight228.41
XLogP6.8
Topological Polar Surface Area20.2
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count13
Heavy Atom Count16
Formal Charge0
Complexity112
SMILES
CCCCCCCCCCCCCCCO
InChI
InChI=1S/C15H32O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16/h16H,2-15H2,1H3
InChIKey
REIUXOLGHVXAEO-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 1-Pentadecanol
CAS: 629-76-5
CID: 12397
Formula: C15H32O
MW: 228.41
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight228.41
XLogP36.8
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count13
Exact Mass228.245315640
Monoisotopic Mass228.245315640
Topological Polar Surface Area20.2 Ų
Heavy Atom Count16
Formal Charge0
Complexity112
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes