Home Halogens Benzene, 2-bromo-1,5-dimethoxy-3-methyl-

Benzene, 2-bromo-1,5-dimethoxy-3-methyl-

CAS No.:
13321-73-8
Catalog Number:
AG0014FQ
Molecular Formula:
C9H11BrO2
Molecular Weight:
231.0864
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Product Description
Catalog Number:
AG0014FQ
Chemical Name:
Benzene, 2-bromo-1,5-dimethoxy-3-methyl-
CAS Number:
13321-73-8
Molecular Formula:
C9H11BrO2
Molecular Weight:
231.0864
MDL Number:
MFCD09265106
IUPAC Name:
2-bromo-1,5-dimethoxy-3-methylbenzene
InChI:
InChI=1S/C9H11BrO2/c1-6-4-7(11-2)5-8(12-3)9(6)10/h4-5H,1-3H3
InChI Key:
RONRLLIJBQHXCI-UHFFFAOYSA-N
SMILES:
COc1cc(OC)c(c(c1)C)Br
NSC Number:
174069
Properties
Complexity:
141  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
229.994g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
231.089g/mol
Monoisotopic Mass:
229.994g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9  
Properties