Name: Name:2-chloro-1-{4-[(2-chloro-6-fluorophenyl)methyl]piperazin-1-yl}ethan-1-one hydrochloride
Brand: Angene
SKU: AG019PAT
Rating: 90 (10 reviews)

2-chloro-1-{4-[(2-chloro-6-fluorophenyl)methyl]piperazin-1-yl}ethan-1-one hydrochloride

CAS No.:

1049738-89-7

Catalog Number:

AG019PAT

Molecular Formula:

C13H16Cl3FN2O

Molecular Weight:

341.6363

Catalog Number:

AG019PAT

Chemical Name:

2-chloro-1-{4-[(2-chloro-6-fluorophenyl)methyl]piperazin-1-yl}ethan-1-one hydrochloride

CAS Number:

1049738-89-7

Molecular Formula:

C13H16Cl3FN2O

Molecular Weight:

341.6363

MDL Number:

MFCD08448709

IUPAC Name:

2-chloro-1-[4-[(2-chloro-6-fluorophenyl)methyl]piperazin-1-yl]ethanone;hydrochloride

InChI:

InChI=1S/C13H15Cl2FN2O.ClH/c14-8-13(19)18-6-4-17(5-7-18)9-10-11(15)2-1-3-12(10)16;/h1-3H,4-9H2;1H

InChI Key:

SPJGVARISWUSKX-UHFFFAOYSA-N

SMILES:

ClCC(=O)N1CCN(CC1)Cc1c(F)cccc1Cl.Cl

Complexity:

311

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

340.031g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

341.632g/mol

Monoisotopic Mass:

340.031g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

23.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count: