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Merck
CN

P5909

Pentadecanolide

Synonym(s):

1-Oxa-2-cyclohexadecanone, 15-Hydroxypentadecanoic acid lactone, 15-Pentadecanolide, Pentalide

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About This Item

Empirical Formula (Hill Notation):
C15H28O2
CAS Number:
106-02-5
Molecular Weight:
240.38
EC Number:
203-354-6
UNSPSC Code:
12352211
MDL number:
MFCD00039667
Beilstein/REAXYS Number:
143710

Key Documents

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InChI

1S/C15H28O2/c16-15-13-11-9-7-5-3-1-2-4-6-8-10-12-14-17-15/h1-14H2

InChI key

FKUPPRZPSYCDRS-UHFFFAOYSA-N

SMILES string

O=C1CCCCCCCCCCCCCCO1

bp

137 °C/2 mmHg (lit.)

mp

34-38 °C (lit.)

density

0.918 g/mL at 25 °C (lit.)

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pictograms

Environment
GHS09

signalword

Warning

hcodes

H410

Hazard Classifications

Aquatic Acute 1 - Aquatic Chronic 2

Storage Class

11 - Combustible Solids

wgk

WGK 1

flash_point_f

320.0 °F - closed cup

flash_point_c

160 °C - closed cup

ppe

Eyeshields, Gloves, type N95 (US)

Regulatory Information

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Certificates of Analysis (COA)

Lot/Batch Number
120H0671

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John Weeks et al.
Journal of applied toxicology : JAT, 40(10), 1421-1434 (2020-06-04)
In vitro metabolic stability of nine fragrance chemicals: p-tolyl acetate, cashmeran, ethylene brassylate, celestolide, galaxolide, traseolide, ambretone, tonalide and pentadecanolide, was evaluated in trout and human hepatocytes. The compounds were incubated with trout hepatocytes at 12°C and human hepatocytes at

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