200,000+ products from a single source!
sales@angenechem.com
1307239-44-6 | Benzonitrile, 5-amino-2-(4-ethyl-1-piperazinyl)-
CAS No: 1307239-44-6 Catalog No: AG000UUI MDL No:MFCD13335184
Product Description
Catalog Number:
AG000UUI
Chemical Name:
Benzonitrile, 5-amino-2-(4-ethyl-1-piperazinyl)-
CAS Number:
1307239-44-6
Molecular Formula:
C13H18N4
Molecular Weight:
230.3088
MDL Number:
MFCD13335184
IUPAC Name:
5-amino-2-(4-ethylpiperazin-1-yl)benzonitrile
InChI:
InChI=1S/C13H18N4/c1-2-16-5-7-17(8-6-16)13-4-3-12(15)9-11(13)10-14/h3-4,9H,2,5-8,15H2,1H3
InChI Key:
VMRVPZCOZRAHHA-UHFFFAOYSA-N
SMILES:
CCN1CCN(CC1)c1ccc(cc1C#N)N
Properties
Complexity:
287
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
230.153g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
230.315g/mol
Monoisotopic Mass:
230.153g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
56.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.