Home Carboxys 6-tert-butyl 2-methyl 7,8-dihydropyrrolo[3,2-e]indole-2,6(3H)-dicarboxylate

6-tert-butyl 2-methyl 7,8-dihydropyrrolo[3,2-e]indole-2,6(3H)-dicarboxylate

CAS No.:
107474-66-8
Catalog Number:
AG01DJU7
Molecular Formula:
C17H20N2O4
Molecular Weight:
316.3517
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Product Description
Catalog Number:
AG01DJU7
Chemical Name:
6-tert-butyl 2-methyl 7,8-dihydropyrrolo[3,2-e]indole-2,6(3H)-dicarboxylate
CAS Number:
107474-66-8
Molecular Formula:
C17H20N2O4
Molecular Weight:
316.3517
MDL Number:
MFCD24465940
IUPAC Name:
6-O-tert-butyl 2-O-methyl 7,8-dihydro-3H-pyrrolo[3,2-e]indole-2,6-dicarboxylate
InChI:
InChI=1S/C17H20N2O4/c1-17(2,3)23-16(21)19-8-7-10-11-9-13(15(20)22-4)18-12(11)5-6-14(10)19/h5-6,9,18H,7-8H2,1-4H3
InChI Key:
MIZUMQMOWWRMIR-UHFFFAOYSA-N
SMILES:
COC(=O)c1[nH]c2c(c1)c1CCN(c1cc2)C(=O)OC(C)(C)C
Properties
Complexity:
488  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
316.142g/mol
Formal Charge:
0
Heavy Atom Count:
23  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
316.357g/mol
Monoisotopic Mass:
316.142g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
71.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3  
Properties