Name: Name:tert-Butyl 6-cyano-2-(2-(4-ethyl-3-iodophenyl)propan-2-yl)-1h-indole-3-carboxylate
Brand: Angene
SKU: AG000OAI
Rating: 90 (10 reviews)

tert-Butyl 6-cyano-2-(2-(4-ethyl-3-iodophenyl)propan-2-yl)-1h-indole-3-carboxylate

CAS No.:

1256584-75-4

Catalog Number:

AG000OAI

Molecular Formula:

C25H27IN2O2

Molecular Weight:

514.3985

Pack Size

Purity

Availability

Location

Price(USD)

Quantity

98%(HPLC)

In Stock USA

United States

$150

- +

98%(HPLC)

In Stock USA

United States

$410

- +

25g

98%(HPLC)

In Stock USA

United States

$1205

- +

Catalog Number:

AG000OAI

Chemical Name:

tert-Butyl 6-cyano-2-(2-(4-ethyl-3-iodophenyl)propan-2-yl)-1h-indole-3-carboxylate

CAS Number:

1256584-75-4

Molecular Formula:

C25H27IN2O2

Molecular Weight:

514.3985

MDL Number:

MFCD22571223

IUPAC Name:

tert-butyl 6-cyano-2-[2-(4-ethyl-3-iodophenyl)propan-2-yl]-1H-indole-3-carboxylate

InChI:

InChI=1S/C25H27IN2O2/c1-7-16-9-10-17(13-19(16)26)25(5,6)22-21(23(29)30-24(2,3)4)18-11-8-15(14-27)12-20(18)28-22/h8-13,28H,7H2,1-6H3

InChI Key:

QJJFMODIDDQXRV-UHFFFAOYSA-N

SMILES:

CCc1ccc(cc1I)C(c1[nH]c2c(c1C(=O)OC(C)(C)C)ccc(c2)C#N)(C)C

EC Number:

812-677-7

Complexity:

676

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

514.112g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

514.407g/mol

Monoisotopic Mass:

514.112g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

65.9A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

6.9