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Home > Fluorides > 126534-41-6
126534-41-6 | Benzenemethanol, 3,4-difluoro-α-methyl-, (αR)-
CAS No: 126534-41-6 Catalog No: AG000SX1 MDL No:MFCD09863750
Product Description
Catalog Number:
AG000SX1
Chemical Name:
Benzenemethanol, 3,4-difluoro-α-methyl-, (αR)-
CAS Number:
126534-41-6
Molecular Formula:
C8H8F2O
Molecular Weight:
158.1453
MDL Number:
MFCD09863750
IUPAC Name:
(1R)-1-(3,4-difluorophenyl)ethanol
InChI:
InChI=1S/C8H8F2O/c1-5(11)6-2-3-7(9)8(10)4-6/h2-5,11H,1H3/t5-/m1/s1
InChI Key:
WSIJRUFDDILTTN-RXMQYKEDSA-N
SMILES:
C[C@H](c1ccc(c(c1)F)F)O
Properties
Complexity:
129
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
158.054g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
158.148g/mol
Monoisotopic Mass:
158.054g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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