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86786-24-5 | 1-Bromo-4-isopropoxy-2-methylbenzene
CAS No: 86786-24-5 Catalog No: AG01EXZU MDL No:MFCD18917791
Product Description
Catalog Number:
AG01EXZU
Chemical Name:
1-Bromo-4-isopropoxy-2-methylbenzene
CAS Number:
86786-24-5
Molecular Formula:
C10H13BrO
Molecular Weight:
229.1136
MDL Number:
MFCD18917791
IUPAC Name:
1-bromo-2-methyl-4-propan-2-yloxybenzene
InChI:
InChI=1S/C10H13BrO/c1-7(2)12-9-4-5-10(11)8(3)6-9/h4-7H,1-3H3
InChI Key:
ISQADIFNVMNUSO-UHFFFAOYSA-N
SMILES:
CC(Oc1ccc(c(c1)C)Br)C
Properties
Complexity:
136
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
228.015g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
229.117g/mol
Monoisotopic Mass:
228.015g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.4
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