3-BROMO-4-METHOXYTOLUENE


Chemical Name: 3-BROMO-4-METHOXYTOLUENE
CAS Number: 22002-45-5
Product Number: AG006XTS(AGN-PC-0WA886)
Synonyms:
MDL No:
Molecular Formula: C8H9BrO
Molecular Weight: 201.0605

Identification/Properties


Computed Properties
Molecular Weight:
201.063g/mol
XLogP3:
3.1
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
1
Rotatable Bond Count:
1
Exact Mass:
199.984g/mol
Monoisotopic Mass:
199.984g/mol
Topological Polar Surface Area:
9.2A^2
Heavy Atom Count:
10
Formal Charge:
0
Complexity:
105
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

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NMR Spectrum


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