Name: Name:1-(4-nitrophenyl)butane-1,3-dione
Brand: Angene
SKU: AG00C6WH
Rating: 90 (10 reviews)

1-(4-nitrophenyl)butane-1,3-dione

CAS No.:

4023-82-9

Catalog Number:

AG00C6WH

Molecular Formula:

C10H9NO4

Molecular Weight:

207.1828

Catalog Number:

AG00C6WH

Chemical Name:

1-(4-nitrophenyl)butane-1,3-dione

CAS Number:

4023-82-9

Molecular Formula:

C10H9NO4

Molecular Weight:

207.1828

MDL Number:

MFCD00187226

IUPAC Name:

1-(4-nitrophenyl)butane-1,3-dione

InChI:

InChI=1S/C10H9NO4/c1-7(12)6-10(13)8-2-4-9(5-3-8)11(14)15/h2-5H,6H2,1H3

InChI Key:

UUFHFNDYTYXICJ-UHFFFAOYSA-N

SMILES:

CC(=O)CC(=O)c1ccc(cc1)[N+](=O)[O-]

NSC Number:

21486

Complexity:

274

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

207.053g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

207.185g/mol

Monoisotopic Mass:

207.053g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

80A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.4