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Structure

5-(2-Bromo-1-oxopropoxy)pentyl acrylate

CAS
94023-68-4
Catalog Number
ACM94023684
Category
Other Products
Molecular Weight
293.15428
Molecular Formula
C11H17BrO4

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Specification

Synonyms
EINECS 301-666-8, CID3023345, 5-(2-Bromo-1-oxopropoxy)pentyl acrylate, 94023-68-4
IUPAC Name
5-prop-2-enoyloxypentyl 2-bromopropanoate
Canonical SMILES
CC(C(=O)OCCCCCOC(=O)C=C)Br
InChI Key
ILSWEUDQMRFOAY-UHFFFAOYSA-N
Boiling Point
334ºC at 760mmHg
Flash Point
155.8ºC
Density
1.298g/cm³
EC Number
301-666-8
Exact Mass
292.03100
H-Bond Acceptor
4
H-Bond Donor
0
What is the molecular formula of 5-(2-Bromo-1-oxopropoxy)pentyl acrylate?

The molecular formula of 5-(2-Bromo-1-oxopropoxy)pentyl acrylate is C11H17BrO4.

What is the molecular weight of 5-(2-Bromo-1-oxopropoxy)pentyl acrylate?

The molecular weight of 5-(2-Bromo-1-oxopropoxy)pentyl acrylate is 293.15 g/mol.

What is the IUPAC name of 5-(2-Bromo-1-oxopropoxy)pentyl acrylate?

The IUPAC name of 5-(2-Bromo-1-oxopropoxy)pentyl acrylate is 5-prop-2-enoyloxypentyl 2-bromopropanoate.

What is the InChI of 5-(2-Bromo-1-oxopropoxy)pentyl acrylate?

The InChI of 5-(2-Bromo-1-oxopropoxy)pentyl acrylate is InChI=1S/C11H17BrO4/c1-3-10(13)15-7-5-4-6-8-16-11(14)9(2)12/h3,9H,1,4-8H2,2H3.

What is the InChIKey of 5-(2-Bromo-1-oxopropoxy)pentyl acrylate?

The InChIKey of 5-(2-Bromo-1-oxopropoxy)pentyl acrylate is ILSWEUDQMRFOAY-UHFFFAOYSA-N.

How many hydrogen bond donor counts does 5-(2-Bromo-1-oxopropoxy)pentyl acrylate have?

5-(2-Bromo-1-oxopropoxy)pentyl acrylate has 0 hydrogen bond donor counts.

What is the XLogP3-AA value of 5-(2-Bromo-1-oxopropoxy)pentyl acrylate?

The XLogP3-AA value of 5-(2-Bromo-1-oxopropoxy)pentyl acrylate is 2.9.

How many rotatable bond counts does 5-(2-Bromo-1-oxopropoxy)pentyl acrylate have?

5-(2-Bromo-1-oxopropoxy)pentyl acrylate has 10 rotatable bond counts.

What is the topological polar surface area of 5-(2-Bromo-1-oxopropoxy)pentyl acrylate?

The topological polar surface area of 5-(2-Bromo-1-oxopropoxy)pentyl acrylate is 52.6 Ų.

Is 5-(2-Bromo-1-oxopropoxy)pentyl acrylate considered a canonicalized compound?

Yes, 5-(2-Bromo-1-oxopropoxy)pentyl acrylate is a canonicalized compound.

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