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1269232-95-2 | Benzenamine, 3-bromo-5-chloro-2-fluoro-
CAS No: 1269232-95-2 Catalog No: AG000THH MDL No:
Product Description
Catalog Number:
AG000THH
Chemical Name:
Benzenamine, 3-bromo-5-chloro-2-fluoro-
CAS Number:
1269232-95-2
Molecular Formula:
C6H4BrClFN
Molecular Weight:
224.4581
IUPAC Name:
3-bromo-5-chloro-2-fluoroaniline
InChI:
InChI=1S/C6H4BrClFN/c7-4-1-3(8)2-5(10)6(4)9/h1-2H,10H2
InChI Key:
CSHMFIIPOVGVDN-UHFFFAOYSA-N
SMILES:
Clc1cc(N)c(c(c1)Br)F
Properties
Complexity:
124
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
222.92g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
224.457g/mol
Monoisotopic Mass:
222.92g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
26A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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