Home Other Building Blocks 1H-Indole-2-acetic acid, 1-methyl-

1H-Indole-2-acetic acid, 1-methyl-

CAS No.:
127019-98-1
Catalog Number:
AG000WK8
Molecular Formula:
C11H11NO2
Molecular Weight:
189.2105
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Product Description
Catalog Number:
AG000WK8
Chemical Name:
1H-Indole-2-acetic acid, 1-methyl-
CAS Number:
127019-98-1
Molecular Formula:
C11H11NO2
Molecular Weight:
189.2105
MDL Number:
MFCD09028672
IUPAC Name:
2-(1-methylindol-2-yl)acetic acid
InChI:
InChI=1S/C11H11NO2/c1-12-9(7-11(13)14)6-8-4-2-3-5-10(8)12/h2-6H,7H2,1H3,(H,13,14)
InChI Key:
WOSJKENLZHUUMC-UHFFFAOYSA-N
SMILES:
OC(=O)Cc1cc2c(n1C)cccc2
Properties
Complexity:
229  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
189.079g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
189.214g/mol
Monoisotopic Mass:
189.079g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
42.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9  
Literature
Title Journal
The light-induced reactions of tryptophan with halocompounds. Photochemistry and photobiology 20020401
Properties