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1026796-70-2 | Phenol, 3-bromo-5-ethoxy-
CAS No: 1026796-70-2 Catalog No: AG000837 MDL No:MFCD12405424
Product Description
Catalog Number:
AG000837
Chemical Name:
Phenol, 3-bromo-5-ethoxy-
CAS Number:
1026796-70-2
Molecular Formula:
C8H9BrO2
Molecular Weight:
217.0599
MDL Number:
MFCD12405424
IUPAC Name:
3-bromo-5-ethoxyphenol
InChI:
InChI=1S/C8H9BrO2/c1-2-11-8-4-6(9)3-7(10)5-8/h3-5,10H,2H2,1H3
InChI Key:
YUZHOUVYLSTTRB-UHFFFAOYSA-N
SMILES:
CCOc1cc(O)cc(c1)Br
Properties
Complexity:
119
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
215.979g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
217.062g/mol
Monoisotopic Mass:
215.979g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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