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1000576-15-7 | Isopropyl 2-[2-(4-bromophenyl)hydrazono]-2-chloroacetate
CAS No: 1000576-15-7 Catalog No: AG01F7DU MDL No:
Product Description
Catalog Number:
AG01F7DU
Chemical Name:
Isopropyl 2-[2-(4-bromophenyl)hydrazono]-2-chloroacetate
CAS Number:
1000576-15-7
Molecular Formula:
C11H12BrClN2O2
Molecular Weight:
319.5822
IUPAC Name:
propan-2-yl (2E)-2-[(4-bromophenyl)hydrazinylidene]-2-chloroacetate
InChI:
InChI=1S/C11H12BrClN2O2/c1-7(2)17-11(16)10(13)15-14-9-5-3-8(12)4-6-9/h3-7,14H,1-2H3/b15-10+
InChI Key:
UQRFIWFWKPQYQI-XNTDXEJSSA-N
SMILES:
CC(OC(=O)/C(=N\Nc1ccc(cc1)Br)/Cl)C
Properties
Complexity:
289
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Exact Mass:
317.977g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
319.583g/mol
Monoisotopic Mass:
317.977g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
50.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.3
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