Name: Name:P-Toluenesulfonic acid 3-nitrophenyl ester
Brand: Angene
SKU: AG003U0Y
Rating: 90 (10 reviews)

P-Toluenesulfonic acid 3-nitrophenyl ester

CAS No.:

3899-90-9

Catalog Number:

AG003U0Y

Molecular Formula:

C13H11NO5S

Molecular Weight:

293.2951

Pack Size

Purity

Availability

Location

Price(USD)

Quantity

25g

>98.0%(GC)

1 week

United States

$387

- +

Product Description

Catalog Number:

AG003U0Y

Chemical Name:

P-Toluenesulfonic acid 3-nitrophenyl ester

CAS Number:

3899-90-9

Molecular Formula:

C13H11NO5S

Molecular Weight:

293.2951

MDL Number:

MFCD00060140

IUPAC Name:

(3-nitrophenyl) 4-methylbenzenesulfonate

InChI:

InChI=1S/C13H11NO5S/c1-10-5-7-13(8-6-10)20(17,18)19-12-4-2-3-11(9-12)14(15)16/h2-9H,1H3

InChI Key:

QRMMIQVSVATYQP-UHFFFAOYSA-N

SMILES:

Cc1ccc(cc1)S(=O)(=O)Oc1cccc(c1)[N+](=O)[O-]

NSC Number:

6905

Properties

Complexity:

431

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

293.036g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

293.293g/mol

Monoisotopic Mass:

293.036g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

97.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

3.3

Literature

Title	Journal
Microsphere-based protease assays and screening application for lethal factor and factor Xa.	Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501

Properties