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1309932-95-3

1309932-95-3 | 1-Bromo-4-iso-butyloxy-3-fluorobenzene

CAS No: 1309932-95-3 Catalog No: AG01ES4C MDL No:

Product Description

Catalog Number:
AG01ES4C
Chemical Name:
1-Bromo-4-iso-butyloxy-3-fluorobenzene
CAS Number:
1309932-95-3
Molecular Formula:
C10H12BrFO
Molecular Weight:
247.1041
IUPAC Name:
4-bromo-2-fluoro-1-(2-methylpropoxy)benzene
InChI:
InChI=1S/C10H12BrFO/c1-7(2)6-13-10-4-3-8(11)5-9(10)12/h3-5,7H,6H2,1-2H3
InChI Key:
XAVOLXDJLVSTFF-UHFFFAOYSA-N
SMILES:
CC(COc1ccc(cc1F)Br)C

Properties

Complexity:
152  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
246.006g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
247.107g/mol
Monoisotopic Mass:
246.006g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4  

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