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Home > Bromides > 1251034-91-9
1251034-91-9 | 1-(4-Bromo-2-fluorophenyl)-2-pentanol
CAS No: 1251034-91-9 Catalog No: AG01ER9Y MDL No:
Product Description
Catalog Number:
AG01ER9Y
Chemical Name:
1-(4-Bromo-2-fluorophenyl)-2-pentanol
CAS Number:
1251034-91-9
Molecular Formula:
C11H14BrFO
Molecular Weight:
261.1307
IUPAC Name:
1-(4-bromo-2-fluorophenyl)pentan-2-ol
InChI:
InChI=1S/C11H14BrFO/c1-2-3-10(14)6-8-4-5-9(12)7-11(8)13/h4-5,7,10,14H,2-3,6H2,1H3
InChI Key:
GGFQCINRSWMIDV-UHFFFAOYSA-N
SMILES:
CCCC(Cc1ccc(cc1F)Br)O
Properties
Complexity:
165
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
260.021g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
261.134g/mol
Monoisotopic Mass:
260.021g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
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