Home Carboxys 6,8-difluoro-3,4-dihydro-2H-1-benzopyran-3-carboxylic acid

6,8-difluoro-3,4-dihydro-2H-1-benzopyran-3-carboxylic acid

CAS No.:
1528456-18-9
Catalog Number:
AG01BAO8
Molecular Formula:
C10H8F2O3
Molecular Weight:
214.1655
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG01BAO8
Chemical Name:
6,8-difluoro-3,4-dihydro-2H-1-benzopyran-3-carboxylic acid
CAS Number:
1528456-18-9
Molecular Formula:
C10H8F2O3
Molecular Weight:
214.1655
MDL Number:
MFCD31559601
IUPAC Name:
6,8-difluoro-3,4-dihydro-2H-chromene-3-carboxylic acid
InChI:
InChI=1S/C10H8F2O3/c11-7-2-5-1-6(10(13)14)4-15-9(5)8(12)3-7/h2-3,6H,1,4H2,(H,13,14)
InChI Key:
ARCSVLRWXYYGNH-UHFFFAOYSA-N
SMILES:
Fc1cc2CC(COc2c(c1)F)C(=O)O
Properties
Complexity:
259  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
214.044g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
214.168g/mol
Monoisotopic Mass:
214.044g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  
Properties