Home Halogens 2-(4-bromo-2,6-dimethylphenyl)acetic acid

2-(4-bromo-2,6-dimethylphenyl)acetic acid

CAS No.:
186748-46-9
Catalog Number:
AG00AN3Z
Molecular Formula:
C10H11BrO2
Molecular Weight:
243.0971
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Product Description
Catalog Number:
AG00AN3Z
Chemical Name:
2-(4-bromo-2,6-dimethylphenyl)acetic acid
CAS Number:
186748-46-9
Molecular Formula:
C10H11BrO2
Molecular Weight:
243.0971
IUPAC Name:
2-(4-bromo-2,6-dimethylphenyl)acetic acid
InChI:
InChI=1S/C10H11BrO2/c1-6-3-8(11)4-7(2)9(6)5-10(12)13/h3-4H,5H2,1-2H3,(H,12,13)
InChI Key:
ARQKHJYNMJGZET-UHFFFAOYSA-N
SMILES:
OC(=O)Cc1c(C)cc(cc1C)Br
Properties
Complexity:
181  
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:
1  
Isotope Atom Count:
0
Molecular Weight:
243.1g/mol
Monoisotopic Mass:
241.994g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8  
Properties