Home Other Building Blocks 1-Bromo-4-methoxy-2,5-dimethylbenzene

1-Bromo-4-methoxy-2,5-dimethylbenzene

CAS No.:
58106-25-5
Catalog Number:
AG003E4Z
Molecular Formula:
C9H11BrO
Molecular Weight:
215.0870
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Product Description
Catalog Number:
AG003E4Z
Chemical Name:
1-Bromo-4-methoxy-2,5-dimethylbenzene
CAS Number:
58106-25-5
Molecular Formula:
C9H11BrO
Molecular Weight:
215.0870
MDL Number:
MFCD01652198
IUPAC Name:
1-bromo-4-methoxy-2,5-dimethylbenzene
InChI:
InChI=1S/C9H11BrO/c1-6-5-9(11-3)7(2)4-8(6)10/h4-5H,1-3H3
InChI Key:
YSSZMKUHFOKNPD-UHFFFAOYSA-N
SMILES:
COc1cc(C)c(cc1C)Br
Properties
Complexity:
127  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
213.999g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
215.09g/mol
Monoisotopic Mass:
213.999g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3  
Properties