Name: Name:methyl 2,2-dimethyl-3-oxo-2,3-dihydro-1H-indene-1-carboxylate
Brand: Angene
SKU: AG01EJYX
Rating: 90 (10 reviews)

methyl 2,2-dimethyl-3-oxo-2,3-dihydro-1H-indene-1-carboxylate

CAS No.:

832089-61-9

Catalog Number:

AG01EJYX

Molecular Formula:

C13H14O3

Molecular Weight:

218.2485

Catalog Number:

AG01EJYX

Chemical Name:

methyl 2,2-dimethyl-3-oxo-2,3-dihydro-1H-indene-1-carboxylate

CAS Number:

832089-61-9

Molecular Formula:

C13H14O3

Molecular Weight:

218.2485

MDL Number:

MFCD31691263

IUPAC Name:

methyl 2,2-dimethyl-3-oxo-1H-indene-1-carboxylate

InChI:

InChI=1S/C13H14O3/c1-13(2)10(12(15)16-3)8-6-4-5-7-9(8)11(13)14/h4-7,10H,1-3H3

InChI Key:

RPMBVQRHROMPEA-UHFFFAOYSA-N

SMILES:

COC(=O)C1c2ccccc2C(=O)C1(C)C

Complexity:

319

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

218.094g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

218.252g/mol

Monoisotopic Mass:

218.094g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

43.4A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.2