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1250847-42-7 | 1-iodo-3-propoxybenzene
CAS No: 1250847-42-7 Catalog No: AG01BUSE MDL No:MFCD14644566
Product Description
Catalog Number:
AG01BUSE
Chemical Name:
1-iodo-3-propoxybenzene
CAS Number:
1250847-42-7
Molecular Formula:
C9H11IO
Molecular Weight:
262.0875
MDL Number:
MFCD14644566
IUPAC Name:
1-iodo-3-propoxybenzene
InChI:
InChI=1S/C9H11IO/c1-2-6-11-9-5-3-4-8(10)7-9/h3-5,7H,2,6H2,1H3
InChI Key:
ILIZHABPJGFCIE-UHFFFAOYSA-N
SMILES:
CCCOc1cccc(c1)I
Properties
Complexity:
106
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
261.985g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
262.09g/mol
Monoisotopic Mass:
261.985g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7
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