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Home > Bromides > 1332347-30-4
1332347-30-4 | 1-Bromo-2-methyl-4-iso-pentyloxybenzene
CAS No: 1332347-30-4 Catalog No: AG01ES7R MDL No:
Product Description
Catalog Number:
AG01ES7R
Chemical Name:
1-Bromo-2-methyl-4-iso-pentyloxybenzene
CAS Number:
1332347-30-4
Molecular Formula:
C12H17BrO
Molecular Weight:
257.1668
IUPAC Name:
1-bromo-2-methyl-4-(3-methylbutoxy)benzene
InChI:
InChI=1S/C12H17BrO/c1-9(2)6-7-14-11-4-5-12(13)10(3)8-11/h4-5,8-9H,6-7H2,1-3H3
InChI Key:
WVQSOEJNFADHQK-UHFFFAOYSA-N
SMILES:
CC(CCOc1ccc(c(c1)C)Br)C
Properties
Complexity:
158
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
256.046g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
257.171g/mol
Monoisotopic Mass:
256.046g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.6
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