Name: Name:(2E)-3-(4-nitrophenyl)but-2-enoic acid, E
Brand: Angene
SKU: AG01DYYP
Rating: 90 (10 reviews)

(2E)-3-(4-nitrophenyl)but-2-enoic acid, E

CAS No.:

179174-16-4

Catalog Number:

AG01DYYP

Molecular Formula:

C10H9NO4

Molecular Weight:

207.1828

Catalog Number:

AG01DYYP

Chemical Name:

(2E)-3-(4-nitrophenyl)but-2-enoic acid, E

CAS Number:

179174-16-4

Molecular Formula:

C10H9NO4

Molecular Weight:

207.1828

MDL Number:

MFCD25970301

IUPAC Name:

(E)-3-(4-nitrophenyl)but-2-enoic acid

InChI:

InChI=1S/C10H9NO4/c1-7(6-10(12)13)8-2-4-9(5-3-8)11(14)15/h2-6H,1H3,(H,12,13)/b7-6+

InChI Key:

APEDXSVBRQSCED-VOTSOKGWSA-N

SMILES:

OC(=O)/C=C(/c1ccc(cc1)[N+](=O)[O-])\C

Complexity:

284

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:

83.1A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.3