Home Halogens 3-(2-bromophenyl)-2,2-dimethylpropanal

3-(2-bromophenyl)-2,2-dimethylpropanal

CAS No.:
278615-08-0
Catalog Number:
AG01C734
Molecular Formula:
C11H13BrO
Molecular Weight:
241.1243
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Product Description
Catalog Number:
AG01C734
Chemical Name:
3-(2-bromophenyl)-2,2-dimethylpropanal
CAS Number:
278615-08-0
Molecular Formula:
C11H13BrO
Molecular Weight:
241.1243
MDL Number:
MFCD22987376
IUPAC Name:
3-(2-bromophenyl)-2,2-dimethylpropanal
InChI:
InChI=1S/C11H13BrO/c1-11(2,8-13)7-9-5-3-4-6-10(9)12/h3-6,8H,7H2,1-2H3
InChI Key:
BVUKVDGFFWGTSY-UHFFFAOYSA-N
SMILES:
O=CC(Cc1ccccc1Br)(C)C
Properties
Complexity:
177  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
240.015g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
241.128g/mol
Monoisotopic Mass:
240.015g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2  
Properties