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127326-77-6 | Benzene, 4-bromo-2-fluoro-1-propoxy-
CAS No: 127326-77-6 Catalog No: AG000WX2 MDL No:MFCD09749657
Product Description
Catalog Number:
AG000WX2
Chemical Name:
Benzene, 4-bromo-2-fluoro-1-propoxy-
CAS Number:
127326-77-6
Molecular Formula:
C9H10BrFO
Molecular Weight:
233.0775
MDL Number:
MFCD09749657
IUPAC Name:
4-bromo-2-fluoro-1-propoxybenzene
InChI:
InChI=1S/C9H10BrFO/c1-2-5-12-9-4-3-7(10)6-8(9)11/h3-4,6H,2,5H2,1H3
InChI Key:
MHEJXUAOBZGJKW-UHFFFAOYSA-N
SMILES:
CCCOc1ccc(cc1F)Br
Properties
Complexity:
132
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
231.99g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
233.08g/mol
Monoisotopic Mass:
231.99g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
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