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Home Halogens 1-[2-(2-chlorophenoxy)ethyl]-1H-indole-3-carboxylic acid

1-[2-(2-chlorophenoxy)ethyl]-1H-indole-3-carboxylic acid

CAS No.:
892255-06-0
Catalog Number:
AG01A2EZ
Molecular Formula:
C17H14ClNO3
Molecular Weight:
315.7510
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Product Description
Catalog Number:
AG01A2EZ
Chemical Name:
1-[2-(2-chlorophenoxy)ethyl]-1H-indole-3-carboxylic acid
CAS Number:
892255-06-0
Molecular Formula:
C17H14ClNO3
Molecular Weight:
315.7510
MDL Number:
MFCD14713035
IUPAC Name:
1-[2-(2-chlorophenoxy)ethyl]indole-3-carboxylic acid
InChI:
InChI=1S/C17H14ClNO3/c18-14-6-2-4-8-16(14)22-10-9-19-11-13(17(20)21)12-5-1-3-7-15(12)19/h1-8,11H,9-10H2,(H,20,21)
InChI Key:
LHJOKCMLJJDHIM-UHFFFAOYSA-N
SMILES:
Clc1ccccc1OCCn1cc(c2c1cccc2)C(=O)O
Properties
Complexity:
392  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
315.066g/mol
Formal Charge:
0
Heavy Atom Count:
22  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
315.753g/mol
Monoisotopic Mass:
315.066g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
51.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8  
Literature
Title Journal
Microsphere-based protease assays and screening application for lethal factor and factor Xa. Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501
Properties