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Key Documents

W450210

Sigma-Aldrich

Sclareol

natural, ≥95%, FG

Synonym(s):

Labd-14-ene-8,13-diol, (1R,2R,8aS)-Decahydro-1-(3-hydroxy-3-methyl-4-pentenyl)-2,5,5,8a-tetramethyl-2-naphthol

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About This Item

Empirical Formula (Hill Notation):
C20H36O2
CAS Number:
Molecular Weight:
308.50
FEMA Number:
4502
Beilstein:
2054148
MDL number:
UNSPSC Code:
12164502
Flavis number:
02.206
NACRES:
NA.21

biological source

Salvia sclarea L

Quality Level

grade

FG
Halal
Kosher
natural

reg. compliance

EU Regulation 1334/2008 & 178/2002
FDA 21 CFR 117

Assay

≥95%

bp

218-220 °C/19 mmHg (lit.)

mp

95-100 °C (lit.)

application(s)

flavors and fragrances

Documentation

see Safety & Documentation for available documents

food allergen

no known allergens

Organoleptic

woody; balsamic; earthy

SMILES string

CC1(C)CCC[C@@]2(C)[C@H]1CC[C@@](C)(O)[C@@H]2CC[C@@](C)(O)C=C

InChI

1S/C20H36O2/c1-7-18(4,21)13-9-16-19(5)12-8-11-17(2,3)15(19)10-14-20(16,6)22/h7,15-16,21-22H,1,8-14H2,2-6H3/t15-,16+,18-,19-,20+/m0/s1

InChI key

XVULBTBTFGYVRC-HHUCQEJWSA-N

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Storage Class Code

11 - Combustible Solids

WGK

WGK 2

Flash Point(F)

Not applicable

Flash Point(C)

Not applicable


Certificates of Analysis (COA)

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