200,000+ products from a single source!
sales@angenechem.com
131736-83-9 | 1,2,4-Butanetricarboxylic acid, 1-fluoro-2-hydroxy-
CAS No: 131736-83-9 Catalog No: AG000ZNO MDL No:
Product Description
Catalog Number:
AG000ZNO
Chemical Name:
1,2,4-Butanetricarboxylic acid, 1-fluoro-2-hydroxy-
CAS Number:
131736-83-9
Molecular Formula:
C7H9FO7
Molecular Weight:
224.1406
IUPAC Name:
1-fluoro-2-hydroxybutane-1,2,4-tricarboxylic acid
InChI:
InChI=1S/C7H9FO7/c8-4(5(11)12)7(15,6(13)14)2-1-3(9)10/h4,15H,1-2H2,(H,9,10)(H,11,12)(H,13,14)
InChI Key:
ZYUGDRJFHNPCOY-UHFFFAOYSA-N
SMILES:
OC(=O)CCC(C(C(=O)O)F)(C(=O)O)O
Properties
Complexity:
289
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
224.033g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
8
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
224.14g/mol
Monoisotopic Mass:
224.033g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
132A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.2
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.