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88298

Sigma-Aldrich

(±)-Theaspirane

technical, ≥90% (GC)

Synonym(s):

2,6,10,10-Tetramethyl-1-oxaspiro[4.5]dec-6-ene

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About This Item

Empirical Formula (Hill Notation):
C13H22O
CAS Number:
36431-72-8
Molecular Weight:
194.31
Beilstein/REAXYS Number:
1424383
EC Number:
253-031-9
MDL number:
MFCD00085214
UNSPSC Code:
12352100
PubChem Substance ID:
57653297
NACRES:
NA.22

grade

technical

assay

≥90% (GC)

form

liquid

refractive index

n20/D 1.438 (lit.)
n20/D 1.488

bp

68-72 °C/3 mmHg (lit.)

density

0.931 g/mL at 25 °C (lit.)

SMILES string

CC1CCC2(O1)C(C)=CCCC2(C)C

InChI

1S/C13H22O/c1-10-6-5-8-12(3,4)13(10)9-7-11(2)14-13/h6,11H,5,7-9H2,1-4H3

InChI key

GYUZHTWCNKINPY-UHFFFAOYSA-N

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Storage Class

10 - Combustible liquids

wgk_germany

WGK 2

flash_point_f

149.0 °F - closed cup

flash_point_c

65 °C - closed cup

ppe

Eyeshields, Gloves, type N95 (US)

Certificates of Analysis (COA)

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