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Merck
CN

78329

β,β,3-Trimethylbenzenepropanol

reference material

Synonym(s):

2,2-Dimethyl-3-(3-methylphenyl)propanol, 2,2-Dimethyl-3-(3-tolyl)propan-1-ol, 3-(2,2-Dimethyl-3-hydroxypropyl)toluene

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About This Item

Empirical Formula (Hill Notation):
C12H18O
CAS Number:
103694-68-4
Molecular Weight:
178.27
UNSPSC Code:
41116107
Beilstein/REAXYS Number:
3237799
MDL number:
MFCD03701092

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InChI

1S/C12H18O/c1-10-5-4-6-11(7-10)8-12(2,3)9-13/h4-7,13H,8-9H2,1-3H3

SMILES string

CC1=CC=CC(CC(C)(C)CO)=C1

InChI key

FYMOBFDUZIDKMI-UHFFFAOYSA-N

grade

reference material

assay

≥98.0% (GC)

shelf life

limited shelf life, expiry date on the label

application(s)

cleaning products
cosmetics
flavors and fragrances
food and beverages
personal care

format

neat

shipped in

wet ice

storage temp.

−20°C

Quality Level

200

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General description

This reference material (RM) is produced and certified in accordance with ISO/IEC 17025. This RM is traceable to primary material from an NMI, e.g. NIST or NMIJ.
Certified content incl. uncertainty and expiry date are given on the certificate.
Download your certificate at: http://www.sigma-aldrich.com.

hcodes

H412

Hazard Classifications

Aquatic Chronic 3

Storage Class

10 - Combustible liquids

wgk

WGK 1

flash_point_f

269.6 °F - closed cup

flash_point_c

132 °C - closed cup

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Certificates of Analysis (COA)

Lot/Batch Number
BCCC2880
BCBV3113

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