Home Halogens 1-bromo-3-(2,2-diethoxyethyl)benzene

1-bromo-3-(2,2-diethoxyethyl)benzene

CAS No.:
1392146-22-3
Catalog Number:
AG019TU9
Molecular Formula:
C12H17BrO2
Molecular Weight:
273.1662
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Product Description
Catalog Number:
AG019TU9
Chemical Name:
1-bromo-3-(2,2-diethoxyethyl)benzene
CAS Number:
1392146-22-3
Molecular Formula:
C12H17BrO2
Molecular Weight:
273.1662
MDL Number:
MFCD11554222
IUPAC Name:
1-bromo-3-(2,2-diethoxyethyl)benzene
InChI:
InChI=1S/C12H17BrO2/c1-3-14-12(15-4-2)9-10-6-5-7-11(13)8-10/h5-8,12H,3-4,9H2,1-2H3
InChI Key:
WJHTWMDUJGNNHX-UHFFFAOYSA-N
SMILES:
CCOC(Cc1cccc(c1)Br)OCC
Properties
Complexity:
158  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
272.041g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
273.17g/mol
Monoisotopic Mass:
272.041g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5  
Properties