Name: Name:ethyl 2,2-dimethyl-3-(4-nitrophenyl)-3-oxopropanoate
Brand: Angene
SKU: AG01BPT9
Rating: 90 (10 reviews)

ethyl 2,2-dimethyl-3-(4-nitrophenyl)-3-oxopropanoate

CAS No.:

329746-12-5

Catalog Number:

AG01BPT9

Molecular Formula:

C13H15NO5

Molecular Weight:

265.2619

Catalog Number:

AG01BPT9

Chemical Name:

ethyl 2,2-dimethyl-3-(4-nitrophenyl)-3-oxopropanoate

CAS Number:

329746-12-5

Molecular Formula:

C13H15NO5

Molecular Weight:

265.2619

MDL Number:

MFCD27998448

IUPAC Name:

ethyl 2,2-dimethyl-3-(4-nitrophenyl)-3-oxopropanoate

InChI:

InChI=1S/C13H15NO5/c1-4-19-12(16)13(2,3)11(15)9-5-7-10(8-6-9)14(17)18/h5-8H,4H2,1-3H3

InChI Key:

YRAVCJPLIKQACT-UHFFFAOYSA-N

SMILES:

CCOC(=O)C(C(=O)c1ccc(cc1)[N+](=O)[O-])(C)C

Complexity:

364

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

265.095g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

265.265g/mol

Monoisotopic Mass:

265.095g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

89.2A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.8