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16-Hydroxyhexadecanoic Acid

Catalog Number ACM506138
CAS 506-13-8
Structure 16-Hydroxyhexadecanoic Acid
IUPAC Name 16-hydroxyhexadecanoic acid
Synonyms Hexadecanoic Acid, 16-Hydroxy-
Molecular Weight 272.42
Molecular Formula C16H32O3
Canonical SMILES C(CCCCCCCC(=O)O)CCCCCCCO
InChI InChI=1S/C16H32O3/c17-15-13-11-9-7-5-3-1-2-4-6-8-10-12-14-16(18)19/h17H,1-15H2,(H,18,19)
InChI Key UGAGPNKCDRTDHP-UHFFFAOYSA-N
Boiling Point 414.4 °C at 760 mmHg
Melting Point 94-98 °C(lit.)
Flash Point 218.6±17.7 °C
Purity 98%
Density 1.0±0.1 g/cm3
Appearance White solid
Storage Freezer
Complexity 192
Covalently-Bonded Unit Count 1
EC Number 208-028-7
Exact Mass 272.23514488g/mol
Heavy Atom Count 19
Hydrogen Bond Acceptor Count 3
Monoisotopic Mass 272.23514488g/mol
NSC Number 159292
Refractive Index 1.469
Rotatable Bond Count 15
Topological Polar Surface Area 57.5Ų
UNII 7IPP3U0F3I
X Log P3 4.8
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