AC1L9BK5 structure

AC1L9BK5

4-[1,3-bis[(2-methoxyphenyl)methyl]-1,3-diazinan-2-yl]-N,N-bis(2-chloroethyl)-3-methylaniline

Also Known As: Pyrimidine,3-bis(o-methoxybenzyl)-|4-[1,3-bis[(2-methoxyphenyl)methyl]-1,3-diazinan-2-yl]-N,N-bis(2-chloroethyl)-3-methylaniline|4-[1,3-bis[(2-methoxyphenyl)methyl]-1,3-diazinan-2-yl]-N,N-b|4-{1,3-Bis[(2-methoxyphenyl)methyl]-1,3-diazinan-2-yl}-N,N-bis(2-chloroethyl)-3-methylaniline|Benzenamine,n,n-bis(2-chloroethyl)-4-[hexahydro-1,3-bis[(2-methoxyphenyl)methyl]-2-pyrimidinyl]-3-methyl-

CAS: 916-32-5
Molecular Formula C31H39Cl2N3O2
Molecular Weight 555.24194 g/mol
LogP 6.7
Topological Polar Surface Area 28.2 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 5
Rotatable Bonds 12
Exact Mass 555.24194
Monoisotopic Mass 555.24194
Heavy Atoms 38
Complexity 633.0

Chemical Identifiers

CAS Number 916-32-5
SMILES CC1=C(C=CC(=C1)N(CCCl)CCCl)C2N(CCCN2CC3=CC=CC=C3OC)CC4=CC=CC=C4OC
InChIKey ACDVXXSRYALLRP-UHFFFAOYSA-N

Product Overview

AC1L9BK5 (CAS 916-32-5), with molecular formula C31H39Cl2N3O2 and molecular weight 555.24194 g/mol. IUPAC: 4-[1,3-bis[(2-methoxyphenyl)methyl]-1,3-diazinan-2-yl]-N,N-bis(2-chloroethyl)-3-methylaniline.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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