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625446-38-0 | 1-Bromo-4-iso-butyloxy-3-chlorobenzene
CAS No: 625446-38-0 Catalog No: AG01EWOY MDL No:
Product Description
Catalog Number:
AG01EWOY
Chemical Name:
1-Bromo-4-iso-butyloxy-3-chlorobenzene
CAS Number:
625446-38-0
Molecular Formula:
C10H12BrClO
Molecular Weight:
263.5587
IUPAC Name:
4-bromo-2-chloro-1-(2-methylpropoxy)benzene
InChI:
InChI=1S/C10H12BrClO/c1-7(2)6-13-10-4-3-8(11)5-9(10)12/h3-5,7H,6H2,1-2H3
InChI Key:
KTYODRBXQGPKJH-UHFFFAOYSA-N
SMILES:
CC(COc1ccc(cc1Cl)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:
261.976g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
263.559g/mol
Monoisotopic Mass:
261.976g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.1
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