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229027-89-8 | Benzenemethanol, 2-bromo-4-fluoro-
CAS No: 229027-89-8 Catalog No: AG002LEV MDL No:MFCD00672925
Product Description
Catalog Number:
AG002LEV
Chemical Name:
Benzenemethanol, 2-bromo-4-fluoro-
CAS Number:
229027-89-8
Molecular Formula:
C7H6BrFO
Molecular Weight:
205.0243
MDL Number:
MFCD00672925
IUPAC Name:
(2-bromo-4-fluorophenyl)methanol
InChI:
InChI=1S/C7H6BrFO/c8-7-3-6(9)2-1-5(7)4-10/h1-3,10H,4H2
InChI Key:
XGAMLBPEVCLQEJ-UHFFFAOYSA-N
SMILES:
OCc1ccc(cc1Br)F
Properties
Complexity:
110
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
203.959g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
205.026g/mol
Monoisotopic Mass:
203.959g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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