AC1L4JQO structure

AC1L4JQO

N,N-dimethylnitrous amide;bis(2,9,17,24,27-pentaoxa-29-azapentacyclo[13.13.1.03,8.011,29.018,23]nonacosa-3,5,7,18,20,22-hexaene)

Also Known As: 12H-7,11-Nitrilo-6H-dibenzo(b,k)(1,4,7,10,13)pentaoxacycloeicosin, 19,20,22,23-tetrahydro-, compd. with N-methyl-N-nitrosomethanamine (2:1)|N,N-Dimethylnitrous amide--1,2,8a,9,11,12,19,20-octahydro-1,20-propano[1,6,3]benzodioxazocino[2,3-f][1,4,10,7]benzotrioxazacyclododecine (1/2)|N,N-dimethylnitrous amide;2,9,17,24,27-pentaoxa-29-azapentacyclo[13.13.1.03,8.011,29.018,23]nonacosa-3,5,7,18,20,22-hexaene

CAS: 74261-18-0
Molecular Formula C48H60N4O11
Molecular Weight 868.42584 g/mol
LogP 7.2194
Topological Polar Surface Area 131.0 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 15
Rotatable Bonds 0
Exact Mass 868.42584
Monoisotopic Mass 868.42584
Heavy Atoms 63
Complexity 554.0

Chemical Identifiers

CAS Number 74261-18-0
SMILES CN(C)N=O.C1CC2COC3=CC=CC=C3OCCOCC4N2C(C1)COC5=CC=CC=C5O4.C1CC2COC3=CC=CC=C3OCCOCC4N2C(C1)COC5=CC=CC=C5O4
InChIKey MHSMDHLDCCTRIC-UHFFFAOYSA-N

Product Overview

AC1L4JQO (CAS 74261-18-0), with molecular formula C48H60N4O11 and molecular weight 868.42584 g/mol. IUPAC: N,N-dimethylnitrous amide;bis(2,9,17,24,27-pentaoxa-29-azapentacyclo[13.13.1.03,8.011,29.018,23]nonacosa-3,5,7,18,20,22-hexaene).

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