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1247490-36-3

1247490-36-3 | 2-Bromobenzyl-(4-fluorophenyl)ether

CAS No: 1247490-36-3 Catalog No: AG01FDUB MDL No:

Product Description

Catalog Number:
AG01FDUB
Chemical Name:
2-Bromobenzyl-(4-fluorophenyl)ether
CAS Number:
1247490-36-3
Molecular Formula:
C13H10BrFO
Molecular Weight:
281.1203
IUPAC Name:
1-bromo-2-[(4-fluorophenoxy)methyl]benzene
InChI:
InChI=1S/C13H10BrFO/c14-13-4-2-1-3-10(13)9-16-12-7-5-11(15)6-8-12/h1-8H,9H2
InChI Key:
NDSPPTFCIBFOFZ-UHFFFAOYSA-N
SMILES:
Fc1ccc(cc1)OCc1ccccc1Br

Properties

Complexity:
204  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
279.99g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
281.124g/mol
Monoisotopic Mass:
279.99g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.2  

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