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Merck
CN

614998

tert-Butan-d9-ol

greener alternative

98 atom % D

Synonym(s):

2-Methyl-2-propan-d9-ol, tert-Butyl-d9 alcohol

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About This Item

Linear Formula:
C(CD3)3OH
CAS Number:
25725-11-5
Molecular Weight:
83.18
UNSPSC Code:
12352202
PubChem Substance ID:
329759519
MDL number:
MFCD00145361
Isotopic purity:
98 atom % D
Assay:
99% (CP)
Mass shift:
M+9

Key Documents

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InChI

1S/C4H10O/c1-4(2,3)5/h5H,1-3H3/i1D3,2D3,3D3

SMILES string

OC(C([2H])([2H])[2H])(C([2H])([2H])[2H])C([2H])([2H])[2H]

InChI key

DKGAVHZHDRPRBM-GQALSZNTSA-N

isotopic purity

98 atom % D

assay

99% (CP)

greener alternative product score

old score: 32
new score: 7
Find out more about DOZN™ Scoring

greener alternative product characteristics

Atom Economy
Design for Energy Efficiency
Inherently Safer Chemistry for Accident Prevention
Learn more about the Principles of Green Chemistry.

sustainability

Greener Alternative Product

bp

83 °C (lit.)

mp

23-26 °C (lit.)

density

0.868 g/mL at 25 °C

application(s)

pharmaceutical

greener alternative category

Re-engineered

mass shift

M+9

Quality Level

200

Related Categories

General description

We are committed to bringing you Greener Alternative Products that adhere to one of the four categories of Greener Alternatives. This product belongs to the category of Re-engineered Products, demonstrating key improvements in Green Chemistry Principles such as ′Atom Economy′, ′Design for Energy Efficiency′, and ′Inherently Safer Chemical for Accident Prevention.′ Click here to view its DOZN scorecard.

Packaging

This product may be available from bulk stock and can be packaged on demand. For information on pricing, availability and packaging, please contact Stable Isotopes Customer Service.

pictograms

FlameExclamation mark
GHS02,GHS07

signalword

Danger

Hazard Classifications

Acute Tox. 4 Inhalation - Eye Irrit. 2 - Flam. Liq. 2 - STOT SE 3

target_organs

Central nervous system, Respiratory system

Storage Class

3 - Flammable liquids

wgk

WGK 1

flash_point_f

51.8 °F - closed cup

flash_point_c

11 °C - closed cup

Regulatory Information

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Certificates of Analysis (COA)

Lot/Batch Number
MBBD7225
MBBD4529
MBBD4062
MBBC8719
MBBC6761

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