Name: Name:3-fluoro-4-(4-methylpiperazin-1-yl)benzoic acid hydrochloride
Brand: Angene
SKU: AG019VZB
Rating: 90 (10 reviews)

3-fluoro-4-(4-methylpiperazin-1-yl)benzoic acid hydrochloride

CAS No.:

948018-60-8

Catalog Number:

AG019VZB

Molecular Formula:

C12H16ClFN2O2

Molecular Weight:

274.7190

Catalog Number:

AG019VZB

Chemical Name:

3-fluoro-4-(4-methylpiperazin-1-yl)benzoic acid hydrochloride

CAS Number:

948018-60-8

Molecular Formula:

C12H16ClFN2O2

Molecular Weight:

274.7190

MDL Number:

MFCD12912789

IUPAC Name:

3-fluoro-4-(4-methylpiperazin-1-yl)benzoic acid;hydrochloride

InChI:

InChI=1S/C12H15FN2O2.ClH/c1-14-4-6-15(7-5-14)11-3-2-9(12(16)17)8-10(11)13;/h2-3,8H,4-7H2,1H3,(H,16,17);1H

InChI Key:

YRHMNGGCRCNNGJ-UHFFFAOYSA-N

SMILES:

CN1CCN(CC1)c1ccc(cc1F)C(=O)O.Cl

Complexity:

280

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

274.088g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

274.72g/mol

Monoisotopic Mass:

274.088g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

43.8A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count: