200,000+ products from a single source!
sales@angenechem.com
88745-15-7 | 1H-Pyrrole-3,4-dicarbonitrile, 2-amino-5-ethyl-1-pentyl-
CAS No: 88745-15-7 Catalog No: AG004COL MDL No:
Product Description
Catalog Number:
AG004COL
Chemical Name:
1H-Pyrrole-3,4-dicarbonitrile, 2-amino-5-ethyl-1-pentyl-
CAS Number:
88745-15-7
Molecular Formula:
C13H18N4
Molecular Weight:
230.3088
IUPAC Name:
2-amino-5-ethyl-1-pentylpyrrole-3,4-dicarbonitrile
InChI:
InChI=1S/C13H18N4/c1-3-5-6-7-17-12(4-2)10(8-14)11(9-15)13(17)16/h3-7,16H2,1-2H3
InChI Key:
UXTIENADPZXSOQ-UHFFFAOYSA-N
SMILES:
CCCCCn1c(N)c(c(c1CC)C#N)C#N
Properties
Complexity:
334
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:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
230.315g/mol
Monoisotopic Mass:
230.153g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
78.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.