Name: Name:Ethyl 3,6,6-trimethyl-4-oxo-4,5,6,7-tetrahydro-1H-indole-2-carboxylate
Brand: Angene
SKU: AG0078CT
Rating: 90 (10 reviews)

Ethyl 3,6,6-trimethyl-4-oxo-4,5,6,7-tetrahydro-1H-indole-2-carboxylate

CAS No.:

37711-24-3

Catalog Number:

AG0078CT

Molecular Formula:

C14H19NO3

Molecular Weight:

249.3056

Catalog Number:

AG0078CT

Chemical Name:

Ethyl 3,6,6-trimethyl-4-oxo-4,5,6,7-tetrahydro-1H-indole-2-carboxylate

CAS Number:

37711-24-3

Molecular Formula:

C14H19NO3

Molecular Weight:

249.3056

MDL Number:

MFCD06358659

IUPAC Name:

ethyl 3,6,6-trimethyl-4-oxo-5,7-dihydro-1H-indole-2-carboxylate

InChI:

InChI=1S/C14H19NO3/c1-5-18-13(17)12-8(2)11-9(15-12)6-14(3,4)7-10(11)16/h15H,5-7H2,1-4H3

InChI Key:

NSZWVSKVSFAGFP-UHFFFAOYSA-N

SMILES:

CCOC(=O)c1[nH]c2c(c1C)C(=O)CC(C2)(C)C

Complexity:

364

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

249.136g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

249.31g/mol

Monoisotopic Mass:

249.136g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

59.2A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.6