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Structure

3-(Trimethylsilyl)-2-propyn-1-ol

CAS
5272-36-6
Catalog Number
ACM5272366
Category
Silanols
Molecular Weight
128.24
Molecular Formula
C6H12OSi

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Specification

Synonyms
3-trimethylsilylprop-2-yn-1-ol; 3-(Trimethylsilyl)propargyl Alcohol; 3-TriMethylsilyl-2-propyn-1-ol;
IUPAC Name
3-trimethylsilylprop-2-yn-1-ol
Canonical SMILES
C[Si](C)(C)C#CCO
InChI Key
ZVGCJDPEKKEYES-UHFFFAOYSA-N
Boiling Point
76ºC (20 mmHg)
Flash Point
66ºC
Density
0.865
Appearance
Transparent liquid
EC Number
226-094-5
Exact Mass
128.06600
Hazard Statements
Xi:Irritant;
Packing Group
III
Safety Description
S26-S37/39
WGK Germany
3
What is the IUPAC name of the compound?

The IUPAC name of the compound is 3-trimethylsilylprop-2-yn-1-ol.

What is the molecular formula of the compound?

The molecular formula of the compound is C6H12OSi.

What is the molecular weight of the compound?

The molecular weight of the compound is 128.24 g/mol.

What is the CAS number of the compound?

The CAS number of the compound is 5272-36-6.

How many hydrogen bond donor counts does the compound have?

The compound has 1 hydrogen bond donor count.

How many hydrogen bond acceptor counts does the compound have?

The compound has 1 hydrogen bond acceptor count.

How many rotatable bond counts does the compound have?

The compound has 1 rotatable bond count.

What is the exact mass of the compound?

The exact mass of the compound is 128.065741536 g/mol.

What is the topological polar surface area of the compound?

The topological polar surface area of the compound is 20.2Ų.

Is the compound canonically defined?

Yes, the compound is canonically defined.

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