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Structure

Thiocyanic acid,1-methyl-3-(triethoxysilyl)propyl ester

CAS
94087-37-3
Catalog Number
ACM94087373
Category
Other Products
Molecular Weight
277.45572
Molecular Formula
C11H23NO3SSi

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Specification

Synonyms
EINECS 301-931-8, 1-Methyl-3-(triethoxysilyl)propyl thiocyanate, 94087-37-3
IUPAC Name
4-triethoxysilylbutan-2-yl thiocyanate
Canonical SMILES
CCO[Si](CCC(C)SC#N)(OCC)OCC
InChI Key
CSNCCNLXNYETHP-UHFFFAOYSA-N
Boiling Point
311.8ºC at 760mmHg
Flash Point
142.4ºC
Density
1.017g/cm³
EC Number
301-931-8
Exact Mass
277.11700
H-Bond Acceptor
4
H-Bond Donor
0
What is the molecular formula of Thiocyanic acid, 1-methyl-3-(triethoxysilyl)propyl ester?

The molecular formula is C11H23NO3SSi.

What is the molecular weight of Thiocyanic acid, 1-methyl-3-(triethoxysilyl)propyl ester?

The molecular weight is 277.46 g/mol.

What is the IUPAC Name of Thiocyanic acid, 1-methyl-3-(triethoxysilyl)propyl ester?

The IUPAC Name is 4-triethoxysilylbutan-2-yl thiocyanate.

What is the InChIKey of Thiocyanic acid, 1-methyl-3-(triethoxysilyl)propyl ester?

The InChIKey is CSNCCNLXNYETHP-UHFFFAOYSA-N.

What is the Canonical SMILES of Thiocyanic acid, 1-methyl-3-(triethoxysilyl)propyl ester?

The Canonical SMILES is CCO[Si](CCC(C)SC#N)(OCC)OCC.

What is the CAS number of Thiocyanic acid, 1-methyl-3-(triethoxysilyl)propyl ester?

The CAS number is 94087-37-3.

How many Hydrogen Bond Acceptor Count does Thiocyanic acid, 1-methyl-3-(triethoxysilyl)propyl ester have?

It has 5 Hydrogen Bond Acceptor Count.

What is the Exact Mass of Thiocyanic acid, 1-methyl-3-(triethoxysilyl)propyl ester?

The Exact Mass is 277.11679130 g/mol.

How many Rotatable Bond Count does Thiocyanic acid, 1-methyl-3-(triethoxysilyl)propyl ester have?

It has 10 Rotatable Bond Count.

Is the Compound Is Canonicalized for Thiocyanic acid, 1-methyl-3-(triethoxysilyl)propyl ester?

Yes, the Compound Is Canonicalized.

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