Name: Name:Butanoic acid, 2-nitrophenyl ester
Brand: Angene
SKU: AG002PPW
Rating: 90 (10 reviews)

Butanoic acid, 2-nitrophenyl ester

CAS No.:

2487-26-5

Catalog Number:

AG002PPW

Molecular Formula:

C10H11NO4

Molecular Weight:

209.1986

Pack Size

Purity

Availability

Location

Price(USD)

Quantity

Product Description

Catalog Number:

AG002PPW

Chemical Name:

Butanoic acid, 2-nitrophenyl ester

CAS Number:

2487-26-5

Molecular Formula:

C10H11NO4

Molecular Weight:

209.1986

MDL Number:

MFCD00036217

IUPAC Name:

(2-nitrophenyl) butanoate

InChI:

InChI=1S/C10H11NO4/c1-2-5-10(12)15-9-7-4-3-6-8(9)11(13)14/h3-4,6-7H,2,5H2,1H3

InChI Key:

DMBLCROMMOZRCN-UHFFFAOYSA-N

SMILES:

CCCC(=O)Oc1ccccc1[N+](=O)[O-]

EC Number:

219-635-1

NSC Number:

404406

Properties

Complexity:

236

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

209.069g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

209.201g/mol

Monoisotopic Mass:

209.069g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

72.1A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.4

Literature

Title	Journal
Kinetic studies and predictions on the hydrolysis and aminolysis of esters of 2-S-phosphorylacetates.	Beilstein journal of organic chemistry 20100101
Effects of mutations of active site residues and amino acids interacting with the Omega loop on substrate activation of butyrylcholinesterase.	Biochimica et biophysica acta 20010112

Properties