200,000+ products from a single source!
sales@angenechem.com
823177-77-1 | 1H-Indole-3-acetic acid, 1-(4-fluorobenzoyl)-5-hydroxy-2-methyl-
CAS No: 823177-77-1 Catalog No: AG004ZKF MDL No:
Product Description
Catalog Number:
AG004ZKF
Chemical Name:
1H-Indole-3-acetic acid, 1-(4-fluorobenzoyl)-5-hydroxy-2-methyl-
CAS Number:
823177-77-1
Molecular Formula:
C18H14FNO4
Molecular Weight:
327.3065
IUPAC Name:
2-[1-(4-fluorobenzoyl)-5-hydroxy-2-methylindol-3-yl]acetic acid
InChI:
InChI=1S/C18H14FNO4/c1-10-14(9-17(22)23)15-8-13(21)6-7-16(15)20(10)18(24)11-2-4-12(19)5-3-11/h2-8,21H,9H2,1H3,(H,22,23)
InChI Key:
LHBDPFXMHDVFBX-UHFFFAOYSA-N
SMILES:
OC(=O)Cc1c2cc(O)ccc2n(c1C)C(=O)c1ccc(cc1)F
Properties
Complexity:
491
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
327.091g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
327.311g/mol
Monoisotopic Mass:
327.091g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
79.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.