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132623-16-6 | 1H-Indole-3-acetic acid, 2-carboxy-6-chloro-, 3-ethyl ester
CAS No: 132623-16-6 Catalog No: AG0010WS MDL No:
Product Description
Catalog Number:
AG0010WS
Chemical Name:
1H-Indole-3-acetic acid, 2-carboxy-6-chloro-, 3-ethyl ester
CAS Number:
132623-16-6
IUPAC Name:
6-chloro-3-(2-ethoxy-2-oxoethyl)-1H-indole-2-carboxylic acid
InChI:
InChI=1S/C13H12ClNO4/c1-2-19-11(16)6-9-8-4-3-7(14)5-10(8)15-12(9)13(17)18/h3-5,15H,2,6H2,1H3,(H,17,18)
InChI Key:
AQFHADLRVPFAGQ-UHFFFAOYSA-N
Properties
Complexity:
363
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
281.045g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
281.692g/mol
Monoisotopic Mass:
281.045g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
79.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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