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Home > Bromides > 1332347-29-1
1332347-29-1 | 1-Bromo-3-chloro-6-iso-pentyloxybenzene
CAS No: 1332347-29-1 Catalog No: AG01ES7Q MDL No:
Product Description
Catalog Number:
AG01ES7Q
Chemical Name:
1-Bromo-3-chloro-6-iso-pentyloxybenzene
CAS Number:
1332347-29-1
Molecular Formula:
C11H14BrClO
Molecular Weight:
277.5853
IUPAC Name:
2-bromo-4-chloro-1-(3-methylbutoxy)benzene
InChI:
InChI=1S/C11H14BrClO/c1-8(2)5-6-14-11-4-3-9(13)7-10(11)12/h3-4,7-8H,5-6H2,1-2H3
InChI Key:
GPKXCARMXCMTNK-UHFFFAOYSA-N
SMILES:
CC(CCOc1ccc(cc1Br)Cl)C
Properties
Complexity:
163
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
275.992g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
277.586g/mol
Monoisotopic Mass:
275.992g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.4
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