Home Indole and Oxindoles 101601-00-7
101601-00-7,MFCD11215448
Catalog No.:AA0004W2
101601-00-7 | 5-Benzyloxyindole 3-Glyoxylic Acid
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1g
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2 weeks  
$629.00   $440.00
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Technical Information
Catalog Number:
AA0004W2
Chemical Name:
5-Benzyloxyindole 3-Glyoxylic Acid
CAS Number:
101601-00-7
Molecular Formula:
C17H13NO4
Molecular Weight:
295.2894
MDL Number:
MFCD11215448
IUPAC Name:
2-oxo-2-(5-phenylmethoxy-1H-indol-3-yl)acetic acid
InChI:
InChI=1S/C17H13NO4/c19-16(17(20)21)14-9-18-15-7-6-12(8-13(14)15)22-10-11-4-2-1-3-5-11/h1-9,18H,10H2,(H,20,21)
InChI Key:
OLSKVXZVSAPWRO-UHFFFAOYSA-N
SMILES:
OC(=O)C(=O)c1c[nH]c2c1cc(OCc1ccccc1)cc2
Properties
Computed Properties
 
Complexity:
419  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
295.084g/mol
Formal Charge:
0
Heavy Atom Count:
22  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
295.294g/mol
Monoisotopic Mass:
295.084g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
79.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9  

Synonyms
 
101601-00-7 
5-Benzyloxyindole 3-Glyoxylic Acid 
FT-0687963 
MFCD11215448 (95%) 
[5-(benzyloxy)-1H-indol-3-yl](oxo)acetic acid 
2-[5-(Benzyloxy)-1H-indole-3-yl]glyoxylic acid 
1H-Indole-3-acetic acid, alpha-oxo-5-(phenylmethoxy)- 
2-[5-(Benzyloxy)-1H-indol-3-yl]-2-oxoacetic acid, 97% 
2-[5-(Benzyloxy)-1H-indol-3-yl]-2-oxoacetic acid,97% 
2-[5-(BENZYLOXY)-1H-INDOL-3-YL]-2-OXOACETIC ACID 
2-[5-(Benzyloxy)-1H-indol-3-yl]-2-oxoacetic acid ,97% 
2-[5-(Benzyloxy)-1H-indol-3-yl]-2-oxoacetic acid, 97% - 250mg 250mg 
2-oxo-2-(5-phenylmethoxy-1H-indol-3-yl)acetic acid 
2-[5-(Benzyloxy)-3-indolyl]-2-oxoacetic Acid 
SCHEMBL11602121 
MFCD11215448 
ZINC71261637 
AKOS023518211 
AK175452 
SY058565 
Literature
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