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1226248-97-0 | 3-Bromo-[2-(1,3-dioxolan-2-yl)ethoxy]benzene
CAS No: 1226248-97-0 Catalog No: AG01FAKV MDL No:
Product Description
Catalog Number:
AG01FAKV
Chemical Name:
3-Bromo-[2-(1,3-dioxolan-2-yl)ethoxy]benzene
CAS Number:
1226248-97-0
Molecular Formula:
C11H13BrO3
Molecular Weight:
273.1231
IUPAC Name:
2-[2-(3-bromophenoxy)ethyl]-1,3-dioxolane
InChI:
InChI=1S/C11H13BrO3/c12-9-2-1-3-10(8-9)13-5-4-11-14-6-7-15-11/h1-3,8,11H,4-7H2
InChI Key:
NTCYCFIBEXUIRE-UHFFFAOYSA-N
SMILES:
Brc1cccc(c1)OCCC1OCCO1
Properties
Complexity:
183
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
272.005g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
273.126g/mol
Monoisotopic Mass:
272.005g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
27.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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