Name: Name:1H-Indole-3-carboxylic acid, 5-bromo-6-fluoro-, methyl ester
Brand: Angene
SKU: AG001UGF
Rating: 90 (10 reviews)

1H-Indole-3-carboxylic acid, 5-bromo-6-fluoro-, methyl ester

CAS No.:

1638759-63-3

Catalog Number:

AG001UGF

Molecular Formula:

C10H7BrFNO2

Molecular Weight:

272.0705

Catalog Number:

AG001UGF

Chemical Name:

1H-Indole-3-carboxylic acid, 5-bromo-6-fluoro-, methyl ester

CAS Number:

1638759-63-3

Molecular Formula:

C10H7BrFNO2

Molecular Weight:

272.0705

MDL Number:

MFCD27987755

IUPAC Name:

methyl 5-bromo-6-fluoro-1H-indole-3-carboxylate

InChI:

InChI=1S/C10H7BrFNO2/c1-15-10(14)6-4-13-9-3-8(12)7(11)2-5(6)9/h2-4,13H,1H3

InChI Key:

WNEWBCYCMPFEBA-UHFFFAOYSA-N

SMILES:

COC(=O)c1c[nH]c2c1cc(Br)c(c2)F

Complexity:

264

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

270.964g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

272.073g/mol

Monoisotopic Mass:

270.964g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

42.1A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

3.4