Home Halogens 1-(2-bromo-1-fluoroethyl)-3-methoxybenzene

1-(2-bromo-1-fluoroethyl)-3-methoxybenzene

CAS No.:
1785433-77-3
Catalog Number:
AG01DYYH
Molecular Formula:
C9H10BrFO
Molecular Weight:
233.0775
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Product Description
Catalog Number:
AG01DYYH
Chemical Name:
1-(2-bromo-1-fluoroethyl)-3-methoxybenzene
CAS Number:
1785433-77-3
Molecular Formula:
C9H10BrFO
Molecular Weight:
233.0775
MDL Number:
MFCD29999840
IUPAC Name:
1-(2-bromo-1-fluoroethyl)-3-methoxybenzene
InChI:
InChI=1S/C9H10BrFO/c1-12-8-4-2-3-7(5-8)9(11)6-10/h2-5,9H,6H2,1H3
InChI Key:
JBXGRNGFEZIBDX-UHFFFAOYSA-N
SMILES:
BrCC(c1cccc(c1)OC)F
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:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2  
Properties