AC1L5SAB structure

AC1L5SAB

N,N-bis(2-chloroethyl)-4-[(4-fluoro-2-nitrophenyl)iminomethyl]-3-methylaniline

Also Known As: n,n-bis(2-chloroethyl)-4-{(e)-[(4-fluoro-2-nitrophenyl)imino]methyl}-3-methylaniline|N,N-bis(2-chloroethyl)-4-[(4-fluoro-2-nitrophenyl)iminomethy|N,N-bis(2-chloroethyl)-4-[(4-fluoro-2-nitrophenyl)iminomethyl]-3-methylaniline|BENZENAMINE,N,N-BIS(2-CHLOROETHYL)-4-[[(4-FLUORO-2-NITROPHENYL)IMINO]METHYL]-3-METHYL-

CAS: 27845-89-2
Molecular Formula C18H18Cl2FN3O2
Molecular Weight 397.07602 g/mol
LogP 4.8
Topological Polar Surface Area 61.4 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 5
Rotatable Bonds 7
Exact Mass 397.07602
Monoisotopic Mass 397.07602
Heavy Atoms 26
Complexity 472.0

Chemical Identifiers

CAS Number 27845-89-2
SMILES CC1=C(C=CC(=C1)N(CCCl)CCCl)C=NC2=C(C=C(C=C2)F)[N+](=O)[O-]
InChIKey YZKRFSNQAWACCF-UHFFFAOYSA-N

Product Overview

AC1L5SAB (CAS 27845-89-2), with molecular formula C18H18Cl2FN3O2 and molecular weight 397.07602 g/mol. IUPAC: N,N-bis(2-chloroethyl)-4-[(4-fluoro-2-nitrophenyl)iminomethyl]-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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