Home Halogens Oxirane, [(2-bromo-4-chlorophenoxy)methyl]-

Oxirane, [(2-bromo-4-chlorophenoxy)methyl]-

CAS No.:
68224-01-1
Catalog Number:
AG005YKI
Molecular Formula:
C9H8BrClO2
Molecular Weight:
263.5156
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Product Description
Catalog Number:
AG005YKI
Chemical Name:
Oxirane, [(2-bromo-4-chlorophenoxy)methyl]-
CAS Number:
68224-01-1
Molecular Formula:
C9H8BrClO2
Molecular Weight:
263.5156
MDL Number:
MFCD09737731
IUPAC Name:
2-[(2-bromo-4-chlorophenoxy)methyl]oxirane
InChI:
InChI=1S/C9H8BrClO2/c10-8-3-6(11)1-2-9(8)13-5-7-4-12-7/h1-3,7H,4-5H2
InChI Key:
UYDDEAYCMGCKPO-UHFFFAOYSA-N
SMILES:
Clc1ccc(c(c1)Br)OCC1CO1
Properties
Complexity:
179  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
261.94g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
263.515g/mol
Monoisotopic Mass:
261.94g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
21.8A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9  
Properties