Home Other Building Blocks 2-Fluoromandelic acid

2-Fluoromandelic acid

CAS No.:
389-31-1
Catalog Number:
AG003HBY
Molecular Formula:
C8H7FO3
Molecular Weight:
170.1378
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5g
98%
In Stock USA
United States
$41
- +
25g
98%
In Stock USA
United States
$112
- +
100g
98%
In Stock USA
United States
$322
- +
Product Description
Catalog Number:
AG003HBY
Chemical Name:
2-Fluoromandelic acid
CAS Number:
389-31-1
Molecular Formula:
C8H7FO3
Molecular Weight:
170.1378
MDL Number:
MFCD03095382
IUPAC Name:
2-(2-fluorophenyl)-2-hydroxyacetic acid
InChI:
InChI=1S/C8H7FO3/c9-6-4-2-1-3-5(6)7(10)8(11)12/h1-4,7,10H,(H,11,12)
InChI Key:
WWSRHIZZWWDONI-UHFFFAOYSA-N
SMILES:
OC(=O)C(c1ccccc1F)O
Properties
Complexity:
172  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
170.038g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
170.139g/mol
Monoisotopic Mass:
170.038g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
57.5A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9  
Properties