Name: Name:1H-Indole-2-carboxylic acid, 4-bromo-5-methoxy-, ethyl ester
Brand: Angene
SKU: AG0031P1
Rating: 90 (10 reviews)

1H-Indole-2-carboxylic acid, 4-bromo-5-methoxy-, ethyl ester

CAS No.:

30933-69-8

Catalog Number:

AG0031P1

Molecular Formula:

C12H12BrNO3

Molecular Weight:

298.1326

Catalog Number:

AG0031P1

Chemical Name:

1H-Indole-2-carboxylic acid, 4-bromo-5-methoxy-, ethyl ester

CAS Number:

30933-69-8

Molecular Formula:

C12H12BrNO3

Molecular Weight:

298.1326

IUPAC Name:

ethyl 4-bromo-5-methoxy-1H-indole-2-carboxylate

InChI:

InChI=1S/C12H12BrNO3/c1-3-17-12(15)9-6-7-8(14-9)4-5-10(16-2)11(7)13/h4-6,14H,3H2,1-2H3

InChI Key:

NBTXRPQZVZUOGD-UHFFFAOYSA-N

SMILES:

CCOC(=O)c1cc2c([nH]1)ccc(c2Br)OC

Complexity:

287

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

297g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

298.136g/mol

Monoisotopic Mass:

297g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

51.3A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

3.3