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796851-75-7 | Benzofuran, 3-(2-iodoethyl)-6-methoxy-
CAS No: 796851-75-7 Catalog No: AG005IN8 MDL No:
Product Description
Catalog Number:
AG005IN8
Chemical Name:
Benzofuran, 3-(2-iodoethyl)-6-methoxy-
CAS Number:
796851-75-7
Molecular Formula:
C11H11IO2
Molecular Weight:
302.1083
IUPAC Name:
3-(2-iodoethyl)-6-methoxy-1-benzofuran
InChI:
InChI=1S/C11H11IO2/c1-13-9-2-3-10-8(4-5-12)7-14-11(10)6-9/h2-3,6-7H,4-5H2,1H3
InChI Key:
QPCSFOMSPVNFDP-UHFFFAOYSA-N
SMILES:
ICCc1coc2c1ccc(c2)OC
Properties
Complexity:
186
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
301.98g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
302.111g/mol
Monoisotopic Mass:
301.98g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
22.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8
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