Home Halogens 1,3-Dioxane, 2-(3-bromophenyl)-

1,3-Dioxane, 2-(3-bromophenyl)-

CAS No.:
67437-93-8
Catalog Number:
AG0061DX
Molecular Formula:
C10H11BrO2
Molecular Weight:
243.0971
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Product Description
Catalog Number:
AG0061DX
Chemical Name:
1,3-Dioxane, 2-(3-bromophenyl)-
CAS Number:
67437-93-8
Molecular Formula:
C10H11BrO2
Molecular Weight:
243.0971
MDL Number:
MFCD02261778
IUPAC Name:
2-(3-bromophenyl)-1,3-dioxane
InChI:
InChI=1S/C10H11BrO2/c11-9-4-1-3-8(7-9)10-12-5-2-6-13-10/h1,3-4,7,10H,2,5-6H2
InChI Key:
JEMRRZJFAXMRKE-UHFFFAOYSA-N
SMILES:
Brc1cccc(c1)C1OCCCO1
Properties
Complexity:
157  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
241.994g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
243.1g/mol
Monoisotopic Mass:
241.994g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  
Properties