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116668-74-7 | Phenol, 3-bromo-2,6-dichloro-
CAS No: 116668-74-7 Catalog No: AG000CY5 MDL No:MFCD17011993
Product Description
Catalog Number:
AG000CY5
Chemical Name:
Phenol, 3-bromo-2,6-dichloro-
CAS Number:
116668-74-7
Molecular Formula:
C6H3BrCl2O
Molecular Weight:
241.8974
MDL Number:
MFCD17011993
IUPAC Name:
3-bromo-2,6-dichlorophenol
InChI:
InChI=1S/C6H3BrCl2O/c7-3-1-2-4(8)6(10)5(3)9/h1-2,10H
InChI Key:
CQLODYNDWGJUOO-UHFFFAOYSA-N
SMILES:
Clc1ccc(c(c1O)Cl)Br
Properties
Complexity:
122
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
239.874g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
241.893g/mol
Monoisotopic Mass:
239.874g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8
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