Home Carboxys 1-tert-butyl 2-ethyl 5-hydroxy-1H-indole-1,2-dicarboxylate

1-tert-butyl 2-ethyl 5-hydroxy-1H-indole-1,2-dicarboxylate

CAS No.:
796870-15-0
Catalog Number:
AG01BVLB
Molecular Formula:
C16H19NO5
Molecular Weight:
305.3258
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Product Description
Catalog Number:
AG01BVLB
Chemical Name:
1-tert-butyl 2-ethyl 5-hydroxy-1H-indole-1,2-dicarboxylate
CAS Number:
796870-15-0
Molecular Formula:
C16H19NO5
Molecular Weight:
305.3258
MDL Number:
MFCD21364568
IUPAC Name:
1-O-tert-butyl 2-O-ethyl 5-hydroxyindole-1,2-dicarboxylate
InChI:
InChI=1S/C16H19NO5/c1-5-21-14(19)13-9-10-8-11(18)6-7-12(10)17(13)15(20)22-16(2,3)4/h6-9,18H,5H2,1-4H3
InChI Key:
FKYRBBCAGIGTIO-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1cc2c(n1C(=O)OC(C)(C)C)ccc(c2)O
Properties
Complexity:
431  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
305.126g/mol
Formal Charge:
0
Heavy Atom Count:
22  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
305.33g/mol
Monoisotopic Mass:
305.126g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
77.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5  
Properties