200,000+ products from a single source!
sales@angenechem.com
Home > Other Building Blocks > 89736-66-3
89736-66-3 | 2-Pyrrolidinone, 1-(1-methylheptyl)-
CAS No: 89736-66-3 Catalog No: AG0041M5 MDL No:
Product Description
Catalog Number:
AG0041M5
Chemical Name:
2-Pyrrolidinone, 1-(1-methylheptyl)-
CAS Number:
89736-66-3
Molecular Formula:
C12H23NO
Molecular Weight:
197.3171
IUPAC Name:
1-octan-2-ylpyrrolidin-2-one
InChI:
InChI=1S/C12H23NO/c1-3-4-5-6-8-11(2)13-10-7-9-12(13)14/h11H,3-10H2,1-2H3
InChI Key:
GMLRMFHKZIBKSV-UHFFFAOYSA-N
SMILES:
CCCCCCC(N1CCCC1=O)C
Properties
Complexity:
179
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
197.178g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
197.322g/mol
Monoisotopic Mass:
197.178g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
20.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.