200,000+ products from a single source!
sales@angenechem.com
850374-94-6 | 1-tert-Butyl 6-methyl-3-iodo-1H-indole-1,6-dicarboxylate
CAS No: 850374-94-6 Catalog No: AG004ZV0 MDL No:MFCD06797499
Product Description
Catalog Number:
AG004ZV0
Chemical Name:
1-tert-Butyl 6-methyl-3-iodo-1H-indole-1,6-dicarboxylate
CAS Number:
850374-94-6
Molecular Formula:
C15H16INO4
Molecular Weight:
401.1963
MDL Number:
MFCD06797499
IUPAC Name:
1-O-tert-butyl 6-O-methyl 3-iodoindole-1,6-dicarboxylate
InChI:
InChI=1S/C15H16INO4/c1-15(2,3)21-14(19)17-8-11(16)10-6-5-9(7-12(10)17)13(18)20-4/h5-8H,1-4H3
InChI Key:
KFPCBJZNHXTGHX-UHFFFAOYSA-N
SMILES:
COC(=O)c1ccc2c(c1)n(cc2I)C(=O)OC(C)(C)C
Properties
Complexity:
420
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
401.012g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
401.2g/mol
Monoisotopic Mass:
401.012g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
57.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.