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Home Carboxys Ethyl 5-hydroxy-1,2-dimethyl-1h-indole-3-carboxylate

Ethyl 5-hydroxy-1,2-dimethyl-1h-indole-3-carboxylate

CAS No.:
15574-49-9
Catalog Number:
AG001O5M
Molecular Formula:
C13H15NO3
Molecular Weight:
233.2631
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5g
96%
In Stock USA
United States
$13
- +
25g
96%
In Stock USA
United States
$44
- +
100g
96%
In Stock USA
United States
$125
- +
500g
96%
In Stock USA
United States
$375
- +
Product Description
Catalog Number:
AG001O5M
Chemical Name:
Ethyl 5-hydroxy-1,2-dimethyl-1h-indole-3-carboxylate
CAS Number:
15574-49-9
Molecular Formula:
C13H15NO3
Molecular Weight:
233.2631
MDL Number:
MFCD00451373
IUPAC Name:
ethyl 5-hydroxy-1,2-dimethylindole-3-carboxylate
InChI:
InChI=1S/C13H15NO3/c1-4-17-13(16)12-8(2)14(3)11-6-5-9(15)7-10(11)12/h5-7,15H,4H2,1-3H3
InChI Key:
YTBNTDMBGXAOCG-UHFFFAOYSA-N
SMILES:
Cc1c(C(=O)OCC)c2c(n1C)ccc(c2)O
EC Number:
605-026-1
UNII:
Z927X3UJ2W
Properties
Complexity:
294  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
233.105g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
233.267g/mol
Monoisotopic Mass:
233.105g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
51.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  
Literature
Title Journal
Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. Bioorganic & medicinal chemistry letters 20101101
Properties