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1018295-36-7,MFCD10018504
Catalog No.:AA0005KG
1018295-36-7 | (2-Methyl-2,3-dihydro-1h-indol-1-yl)(oxo)acetic acid
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Purity
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Price(USD)
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1g
95%
in stock  
$74.00   $52.00
- +
5g
95%
in stock  
$212.00   $148.00
- +
  • Technical Information
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  • Technical Information
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Technical Information
Catalog Number:
AA0005KG
Chemical Name:
(2-Methyl-2,3-dihydro-1h-indol-1-yl)(oxo)acetic acid
CAS Number:
1018295-36-7
Molecular Formula:
C11H11NO3
Molecular Weight:
205.2099
MDL Number:
MFCD10018504
IUPAC Name:
2-(2-methyl-2,3-dihydroindol-1-yl)-2-oxoacetic acid
InChI:
InChI=1S/C11H11NO3/c1-7-6-8-4-2-3-5-9(8)12(7)10(13)11(14)15/h2-5,7H,6H2,1H3,(H,14,15)
InChI Key:
JGESGOYJOOYVIT-UHFFFAOYSA-N
SMILES:
CC1Cc2c(N1C(=O)C(=O)O)cccc2
Properties
Computed Properties
 
Complexity:
290  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
205.074g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
205.213g/mol
Monoisotopic Mass:
205.074g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
57.6A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  

Synonyms
 
1018295-36-7 
(2-METHYL-2,3-DIHYDRO-1H-INDOL-1-YL)-(OXO)ACETIC ACID 
STK501945 
AKOS005172255 
MCULE-1257703198 
AB0155008 
2-(2-Methylindolin-1-yl)-2-oxoacetic acid 
FT-0679605 
Y-6295 
(2-methyl-2,3-dihydroindol-1-yl)(oxo)acetic acid 
I04-4661 
2-(2-methyl-2,3-dihydro-1H-indol-1-yl)-2-oxoacetic acid 
(2-methyl-2,3-dihydro-1H-indol-1-yl)(oxo)acetic acid 
C11H11NO3 
1H-indole-1-acetic acid, 2,3-dihydro-2-methyl-alpha-oxo- 
CTK4A0284 
DTXSID10649323 
ALBB-009533 
7467AC 
BBL003761 
MFCD10018504 
Literature
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