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1245563-12-5 | Ethanamine, 2-(5-bromo-2-chlorophenoxy)-N,N-dimethyl-
CAS No: 1245563-12-5 Catalog No: AG000M6L MDL No:
Product Description
Catalog Number:
AG000M6L
Chemical Name:
Ethanamine, 2-(5-bromo-2-chlorophenoxy)-N,N-dimethyl-
CAS Number:
1245563-12-5
Molecular Formula:
C10H13BrClNO
Molecular Weight:
278.5733
IUPAC Name:
2-(5-bromo-2-chlorophenoxy)-N,N-dimethylethanamine
InChI:
InChI=1S/C10H13BrClNO/c1-13(2)5-6-14-10-7-8(11)3-4-9(10)12/h3-4,7H,5-6H2,1-2H3
InChI Key:
BKRNSKYGOCWZIK-UHFFFAOYSA-N
SMILES:
CN(CCOc1cc(Br)ccc1Cl)C
Properties
Complexity:
168
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
276.987g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
278.574g/mol
Monoisotopic Mass:
276.987g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
12.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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