CAS
94135-68-9 Purity
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94135-68-9 Purity
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2-Thienylethyl acetate
CAS
94135-73-6
Catalog Number
ACM94135736
Category
Other Products
Molecular Weight
170.228800 [g/mol]
Molecular Formula
C8H10O2S
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Specification
Synonyms
2-Thienylethyl acetate, EINECS 302-944-1, 94135-73-6
IUPAC Name
2-thiophen-2-ylethyl acetate
Canonical SMILES
CC(=O)OCCC1=CC=CS1
InChI Key
DNAUTCUGZWKQBZ-UHFFFAOYSA-N
Boiling Point
218.3ºC at 760mmHg
Flash Point
85.8ºC
Density
1.142g/cm³
EC Number
302-944-1
Exact Mass
170.04000
H-Bond Acceptor
2
H-Bond Donor
0
What is the molecular formula of 2-Thienylethyl acetate according to the reference?
The molecular formula of 2-Thienylethyl acetate is C8H10O2S.
When was 2-Thienylethyl acetate first created?
2-Thienylethyl acetate was first created on December 4, 2007.
What is the IUPAC name of 2-Thienylethyl acetate?
The IUPAC name of 2-Thienylethyl acetate is 2-thiophen-2-ylethyl acetate.
What is the InChIKey of 2-Thienylethyl acetate?
The InChIKey of 2-Thienylethyl acetate is DNAUTCUGZWKQBZ-UHFFFAOYSA-N.
How many hydrogen bond acceptors does 2-Thienylethyl acetate have?
2-Thienylethyl acetate has 3 hydrogen bond acceptors.
What is the topological polar surface area of 2-Thienylethyl acetate?
The topological polar surface area of 2-Thienylethyl acetate is 54.5 Ų.
Is 2-Thienylethyl acetate considered a canonicalized compound?
Yes, 2-Thienylethyl acetate is considered a canonicalized compound.
What is the molecular weight of 2-Thienylethyl acetate?
The molecular weight of 2-Thienylethyl acetate is 170.23 g/mol.
How many rotatable bond counts does 2-Thienylethyl acetate have?
2-Thienylethyl acetate has 4 rotatable bond counts.
What is the CAS number of 2-Thienylethyl acetate?
The CAS number of 2-Thienylethyl acetate is 94135-73-6.
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94135-76-9 Purity
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94135-76-9 Purity
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