1,8-Diazacyclotetradecane-2,9-dione - CAS 56403-09-9

Catalog:	BB042384
Product Name:	1,8-Diazacyclotetradecane-2,9-dione
CAS:	56403-09-9
Synonyms:	7,14-diazacyclotetradecane-1,8-dione; 1,8-Diaza-2,9-diketocyclotetradecane; 1,8-Diaza-2,9-dioxocyclotetradecane; Hexahydro-2H-azepin-2-one Cyclic Dimer; 6-Aminohexanoate Cyclic Dimer; Caprolactam Cyclic Dimer; Caprolactam Dimer; Cyclic Dimer of ε-Caprolactam; 6-Aminohexanoic Acid Bimol; Cyclic Lactam; ε-Aminocaproic Acid Cyclic Dimer; ε-Caprolactam Cyclic Dimer; Nylon-6 cyclic oligomer

Technical Data

IUPAC Name:	1,8-diazacyclotetradecane-2,9-dione
Description:	1,8-Diazacyclotetradecane-2,9-dione (CAS# 56403-09-9 ) is a useful research chemical.
Molecular Weight:	226.32
Molecular Formula:	C12H22N2O2
Canonical SMILES:	C1CCC(=O)NCCCCCC(=O)NCC1
InChI:	InChI=1S/C12H22N2O2/c15-11-7-3-1-5-9-13-12(16)8-4-2-6-10-14-11/h1-10H2,(H,13,16)(H,14,15)
InChI Key:	HERSSAVMHCMYSQ-UHFFFAOYSA-N
Purity:	98 %

Complexity:	205
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	226.168127949
Formal Charge:	0
Heavy Atom Count:	16
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	2
Isotope Atom Count:	0
Monoisotopic Mass:	226.168127949
Rotatable Bond Count:	0
Topological Polar Surface Area:	58.2
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	0.6