Home Carboxys 2-Benzofurancarboxylic acid, 5-(1-piperazinyl)-, ethyl ester, (Hydrochloride), hydrate (1

2-Benzofurancarboxylic acid, 5-(1-piperazinyl)-, ethyl ester, (Hydrochloride), hydrate (1

CAS No.:
1422956-31-7
Catalog Number:
AG009C79
Molecular Formula:
C15H22Cl2N2O4
Molecular Weight:
365.2522
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG009C79
Chemical Name:
2-Benzofurancarboxylic acid, 5-(1-piperazinyl)-, ethyl ester, (Hydrochloride), hydrate (1
CAS Number:
1422956-31-7
Molecular Formula:
C15H22Cl2N2O4
Molecular Weight:
365.2522
MDL Number:
MFCD25977202
IUPAC Name:
ethyl 5-piperazin-1-yl-1-benzofuran-2-carboxylate;hydrate;dihydrochloride
InChI:
InChI=1S/C15H18N2O3.2ClH.H2O/c1-2-19-15(18)14-10-11-9-12(3-4-13(11)20-14)17-7-5-16-6-8-17;;;/h3-4,9-10,16H,2,5-8H2,1H3;2*1H;1H2
InChI Key:
GOKCUPVWRIMFNJ-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1cc2c(o1)ccc(c2)N1CCNCC1.O.Cl.Cl
Properties
Complexity:
344  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
4  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
364.096g/mol
Formal Charge:
0
Heavy Atom Count:
23  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
4  
Isotope Atom Count:
0
Molecular Weight:
365.251g/mol
Monoisotopic Mass:
364.096g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
55.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties