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199287-75-7

199287-75-7 | Benzene, 1-bromo-4-fluoro-2-(2-propyn-1-yloxy)-

CAS No: 199287-75-7 Catalog No: AG002C0U MDL No:

Product Description

Catalog Number:
AG002C0U
Chemical Name:
Benzene, 1-bromo-4-fluoro-2-(2-propyn-1-yloxy)-
CAS Number:
199287-75-7
Molecular Formula:
C9H6BrFO
Molecular Weight:
229.0457
IUPAC Name:
1-bromo-4-fluoro-2-prop-2-ynoxybenzene
InChI:
InChI=1S/C9H6BrFO/c1-2-5-12-9-6-7(11)3-4-8(9)10/h1,3-4,6H,5H2
InChI Key:
LIXUXJLQOIEJKH-UHFFFAOYSA-N
SMILES:
Fc1cc(OCC#C)c(cc1)Br

Properties

Complexity:
186  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
227.959g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
229.048g/mol
Monoisotopic Mass:
227.959g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8  

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