200,000+ products from a single source!
sales@angenechem.com
Home > Other Building Blocks > 202262-40-6
202262-40-6 | Benzoic acid, 3-(1-piperazinyl)-, ethyl ester
CAS No: 202262-40-6 Catalog No: AG002858 MDL No:
Product Description
Catalog Number:
AG002858
Chemical Name:
Benzoic acid, 3-(1-piperazinyl)-, ethyl ester
CAS Number:
202262-40-6
Molecular Formula:
C13H18N2O2
Molecular Weight:
234.2942
IUPAC Name:
ethyl 3-piperazin-1-ylbenzoate
InChI:
InChI=1S/C13H18N2O2/c1-2-17-13(16)11-4-3-5-12(10-11)15-8-6-14-7-9-15/h3-5,10,14H,2,6-9H2,1H3
InChI Key:
MFHSHQIHYPPRMQ-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1cccc(c1)N1CCNCC1
Properties
Complexity:
252
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
234.137g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
234.299g/mol
Monoisotopic Mass:
234.137g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
41.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.