Name: Name:1H-Indole-1-carboxylic acid, 2-bromo-, 1,1-dimethylethyl ester
Brand: Angene
SKU: AG00I4RQ
Rating: 90 (10 reviews)

1H-Indole-1-carboxylic acid, 2-bromo-, 1,1-dimethylethyl ester

CAS No.:

249608-77-3

Catalog Number:

AG00I4RQ

Molecular Formula:

C13H14BrNO2

Molecular Weight:

296.1598

Catalog Number:

AG00I4RQ

Chemical Name:

1H-Indole-1-carboxylic acid, 2-bromo-, 1,1-dimethylethyl ester

CAS Number:

249608-77-3

Molecular Formula:

C13H14BrNO2

Molecular Weight:

296.1598

MDL Number:

MFCD24468397

IUPAC Name:

tert-butyl 2-bromoindole-1-carboxylate

InChI:

InChI=1S/C13H14BrNO2/c1-13(2,3)17-12(16)15-10-7-5-4-6-9(10)8-11(15)14/h4-8H,1-3H3

InChI Key:

YUMOIDXWAKVCJY-UHFFFAOYSA-N

SMILES:

O=C(n1c(Br)cc2c1cccc2)OC(C)(C)C

Complexity:

300

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

295.021g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

296.164g/mol

Monoisotopic Mass:

295.021g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

31.2A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

4.3