CAS 307557-56-8 | Acetic acid, 2-[3-(trifluoromethyl)phenoxy]-, hydrazide | CAS Number 307557-56-8

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307557-56-8 | Acetic acid, 2-[3-(trifluoromethyl)phenoxy]-, hydrazide

CAS No: 307557-56-8 Catalog No: AG00316V MDL No:MFCD03147377

Product Description

Catalog Number:

AG00316V

Chemical Name:

Acetic acid, 2-[3-(trifluoromethyl)phenoxy]-, hydrazide

CAS Number:

307557-56-8

Molecular Formula:

C9H9F3N2O2

Molecular Weight:

234.1752

MDL Number:

MFCD03147377

IUPAC Name:

2-[3-(trifluoromethyl)phenoxy]acetohydrazide

InChI:

InChI=1S/C9H9F3N2O2/c10-9(11,12)6-2-1-3-7(4-6)16-5-8(15)14-13/h1-4H,5,13H2,(H,14,15)

InChI Key:

CVXTVRVYODCHAX-UHFFFAOYSA-N

SMILES:

NNC(=O)COc1cccc(c1)C(F)(F)F

Properties

Complexity:

245

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

234.062g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

234.178g/mol

Monoisotopic Mass:

234.062g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

64.4A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.4

Literature

Title	Journal
Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis.	Bioorganic & medicinal chemistry letters 20101101
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