Name: Name:Propanoic acid, 2-Methyl-, 1-[[(4-nitrophenoxy)carbonyl]oxy]ethyl ester
Brand: Angene
SKU: AG00ABPF
Rating: 90 (10 reviews)

Propanoic acid, 2-Methyl-, 1-[[(4-nitrophenoxy)carbonyl]oxy]ethyl ester

CAS No.:

194995-47-6

Catalog Number:

AG00ABPF

Molecular Formula:

C13H15NO7

Molecular Weight:

297.2607

Catalog Number:

AG00ABPF

Chemical Name:

Propanoic acid, 2-Methyl-, 1-[[(4-nitrophenoxy)carbonyl]oxy]ethyl ester

CAS Number:

194995-47-6

Molecular Formula:

C13H15NO7

Molecular Weight:

297.2607

MDL Number:

MFCD22571566

IUPAC Name:

1-(4-nitrophenoxy)carbonyloxyethyl 2-methylpropanoate

InChI:

InChI=1S/C13H15NO7/c1-8(2)12(15)19-9(3)20-13(16)21-11-6-4-10(5-7-11)14(17)18/h4-9H,1-3H3

InChI Key:

BYKGARIWNYRANY-UHFFFAOYSA-N

SMILES:

CC(OC(=O)C(C)C)OC(=O)Oc1ccc(cc1)[N+](=O)[O-]

Complexity:

383

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

297.085g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

297.263g/mol

Monoisotopic Mass:

297.085g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

108A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

3.4