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Home Carboxys 4-amino-8-fluoro-3-quinolinecarboxylic acid dihydrate

4-amino-8-fluoro-3-quinolinecarboxylic acid dihydrate

CAS No.:
1609407-49-9
Catalog Number:
AG00J1XX
Molecular Formula:
C10H11FN2O4
Molecular Weight:
242.2037
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$96
- +
5g
95%
In Stock USA
United States
$216
- +
Product Description
Catalog Number:
AG00J1XX
Chemical Name:
4-amino-8-fluoro-3-quinolinecarboxylic acid dihydrate
CAS Number:
1609407-49-9
Molecular Formula:
C10H11FN2O4
Molecular Weight:
242.2037
MDL Number:
MFCD10037653
IUPAC Name:
4-amino-8-fluoroquinoline-3-carboxylic acid;dihydrate
InChI:
InChI=1S/C10H7FN2O2.2H2O/c11-7-3-1-2-5-8(12)6(10(14)15)4-13-9(5)7;;/h1-4H,(H2,12,13)(H,14,15);2*1H2
InChI Key:
LYKMCJFMVXAKCE-UHFFFAOYSA-N
SMILES:
OC(=O)c1cnc2c(c1N)cccc2F.O.O
Properties
Complexity:
262  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
242.07g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
4  
Isotope Atom Count:
0
Molecular Weight:
242.206g/mol
Monoisotopic Mass:
242.07g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
78.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties