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84109-21-7 | Benzene, 4-bromo-2-chloro-1-(2-propenyloxy)-
CAS No: 84109-21-7 Catalog No: AG004PVI MDL No:
Product Description
Catalog Number:
AG004PVI
Chemical Name:
Benzene, 4-bromo-2-chloro-1-(2-propenyloxy)-
CAS Number:
84109-21-7
Molecular Formula:
C9H8BrClO
Molecular Weight:
247.5162
IUPAC Name:
4-bromo-2-chloro-1-prop-2-enoxybenzene
InChI:
InChI=1S/C9H8BrClO/c1-2-5-12-9-4-3-7(10)6-8(9)11/h2-4,6H,1,5H2
InChI Key:
ZZRMGQOIFBKQIH-UHFFFAOYSA-N
SMILES:
C=CCOc1ccc(cc1Cl)Br
Properties
Complexity:
152
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
245.945g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
247.516g/mol
Monoisotopic Mass:
245.945g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9
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