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124980-98-9

124980-98-9 | Benzenepropanoic acid, 4-fluoro-α-hydroxy-, methyl ester, (αR)-

CAS No: 124980-98-9 Catalog No: AG000MXW MDL No:MFCD16495900

Product Description

Catalog Number:
AG000MXW
Chemical Name:
Benzenepropanoic acid, 4-fluoro-α-hydroxy-, methyl ester, (αR)-
CAS Number:
124980-98-9
Molecular Formula:
C10H11FO3
Molecular Weight:
198.1909
MDL Number:
MFCD16495900
IUPAC Name:
methyl (2R)-3-(4-fluorophenyl)-2-hydroxypropanoate
InChI:
InChI=1S/C10H11FO3/c1-14-10(13)9(12)6-7-2-4-8(11)5-3-7/h2-5,9,12H,6H2,1H3/t9-/m1/s1
InChI Key:
OKWFDTMQPLAWLR-SECBINFHSA-N
SMILES:
COC(=O)[C@@H](Cc1ccc(cc1)F)O

Properties

Complexity:
188  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0
Exact Mass:
198.069g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
198.193g/mol
Monoisotopic Mass:
198.069g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  

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