Home Carboxys 6-Fluorochroman-3-carboxylic acid

6-Fluorochroman-3-carboxylic acid

CAS No.:
944899-27-8
Catalog Number:
AG00II8H
Molecular Formula:
C10H9FO3
Molecular Weight:
196.1751
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
95%
1 week
United States
$407
- +
Product Description
Catalog Number:
AG00II8H
Chemical Name:
6-Fluorochroman-3-carboxylic acid
CAS Number:
944899-27-8
Molecular Formula:
C10H9FO3
Molecular Weight:
196.1751
MDL Number:
MFCD10696110
IUPAC Name:
6-fluoro-3,4-dihydro-2H-chromene-3-carboxylic acid
InChI:
InChI=1S/C10H9FO3/c11-8-1-2-9-6(4-8)3-7(5-14-9)10(12)13/h1-2,4,7H,3,5H2,(H,12,13)
InChI Key:
POJZDZQAEYSLOK-UHFFFAOYSA-N
SMILES:
OC(=O)C1Cc2cc(F)ccc2OC1
Properties
Complexity:
231  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
196.054g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
196.177g/mol
Monoisotopic Mass:
196.054g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  
Properties