1,3-Dioxolane, 2-(bromomethyl)-2-methyl-


Chemical Name: 1,3-Dioxolane, 2-(bromomethyl)-2-methyl-
CAS Number: 33278-96-5
Product Number: AG00381K(AGN-PC-0JNYPY)
Synonyms:
MDL No:
Molecular Formula: C5H9BrO2
Molecular Weight: 181.0278

Identification/Properties


Computed Properties
Molecular Weight:
181.029g/mol
XLogP3:
0.9
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
1
Exact Mass:
179.979g/mol
Monoisotopic Mass:
179.979g/mol
Topological Polar Surface Area:
18.5A^2
Heavy Atom Count:
8
Formal Charge:
0
Complexity:
78.5
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

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Chemical Structure



The chemical structure of 1,3-Dioxolane, 2-(bromomethyl)-2-methyl- (C5H9BrO2) is as follows: ``` Br | H3C-C-O-CH2 | | H3C-C-O | H ``` This structure represents a 1,3-dioxolane ring with a bromomethyl group attached at the 2-position and a methyl group at the 2-position.