Name: Name:1H-Indole-1-carboxylic acid, 5-fluoro-3-iodo-, 1,1-diMethylethyl ester
Brand: Angene
SKU: AG002FQ0
Rating: 90 (10 reviews)

1H-Indole-1-carboxylic acid, 5-fluoro-3-iodo-, 1,1-diMethylethyl ester

CAS No.:

192189-13-2

Catalog Number:

AG002FQ0

Molecular Formula:

C13H13FINO2

Molecular Weight:

361.1507

Catalog Number:

AG002FQ0

Chemical Name:

1H-Indole-1-carboxylic acid, 5-fluoro-3-iodo-, 1,1-diMethylethyl ester

CAS Number:

192189-13-2

Molecular Formula:

C13H13FINO2

Molecular Weight:

361.1507

MDL Number:

MFCD13183351

IUPAC Name:

tert-butyl 5-fluoro-3-iodoindole-1-carboxylate

InChI:

InChI=1S/C13H13FINO2/c1-13(2,3)18-12(17)16-7-10(15)9-6-8(14)4-5-11(9)16/h4-7H,1-3H3

InChI Key:

DGGDRRGYXBFEIU-UHFFFAOYSA-N

SMILES:

Fc1ccc2c(c1)c(I)cn2C(=O)OC(C)(C)C

Complexity:

331

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

360.998g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

361.155g/mol

Monoisotopic Mass:

360.998g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

31.2A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3: