Home Other Building Blocks 3-CHLORO-4-FLUOROMANDELIC ACID

3-CHLORO-4-FLUOROMANDELIC ACID

CAS No.:
1214377-83-9
Catalog Number:
AG01DYIK
Molecular Formula:
C8H6ClFO3
Molecular Weight:
204.5828
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG01DYIK
Chemical Name:
3-CHLORO-4-FLUOROMANDELIC ACID
CAS Number:
1214377-83-9
Molecular Formula:
C8H6ClFO3
Molecular Weight:
204.5828
MDL Number:
MFCD13194228
IUPAC Name:
2-(3-chloro-4-fluorophenyl)-2-hydroxyacetic acid
InChI:
InChI=1S/C8H6ClFO3/c9-5-3-4(1-2-6(5)10)7(11)8(12)13/h1-3,7,11H,(H,12,13)
InChI Key:
SUFHYSIEHMZFOM-UHFFFAOYSA-N
SMILES:
OC(=O)C(c1ccc(c(c1)Cl)F)O
Properties
Complexity:
200  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
203.999g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
204.581g/mol
Monoisotopic Mass:
203.999g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
57.5A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  
Properties