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1000576-00-0 | Benzyl 2-[2-(4-bromophenyl)hydrazono]-2-chloroacetate
CAS No: 1000576-00-0 Catalog No: AG01F84U MDL No:
Product Description
Catalog Number:
AG01F84U
Chemical Name:
Benzyl 2-[2-(4-bromophenyl)hydrazono]-2-chloroacetate
CAS Number:
1000576-00-0
Molecular Formula:
C15H12BrClN2O2
Molecular Weight:
367.6250
IUPAC Name:
benzyl (2E)-2-[(4-bromophenyl)hydrazinylidene]-2-chloroacetate
InChI:
InChI=1S/C15H12BrClN2O2/c16-12-6-8-13(9-7-12)18-19-14(17)15(20)21-10-11-4-2-1-3-5-11/h1-9,18H,10H2/b19-14+
InChI Key:
GFJZZXLMYPEZLI-XMHGGMMESA-N
SMILES:
Brc1ccc(cc1)N/N=C(\C(=O)OCc1ccccc1)/Cl
Properties
Complexity:
365
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Exact Mass:
365.977g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
367.627g/mol
Monoisotopic Mass:
365.977g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
50.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.9
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