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91912-54-8 | 1-IODO-4-(METHOXYMETHYL)BENZENE
CAS No: 91912-54-8 Catalog No: AG00H2QC MDL No:MFCD11226291
Product Description
Catalog Number:
AG00H2QC
Chemical Name:
1-IODO-4-(METHOXYMETHYL)BENZENE
CAS Number:
91912-54-8
Molecular Formula:
C8H9IO
Molecular Weight:
248.0609
MDL Number:
MFCD11226291
IUPAC Name:
1-iodo-4-(methoxymethyl)benzene
InChI:
InChI=1S/C8H9IO/c1-10-6-7-2-4-8(9)5-3-7/h2-5H,6H2,1H3
InChI Key:
DCQYAEJVEBYSTJ-UHFFFAOYSA-N
SMILES:
COCc1ccc(cc1)I
Properties
Complexity:
87.3
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
247.97g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
248.063g/mol
Monoisotopic Mass:
247.97g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
Literature
| Title | Journal |
|---|---|
| Synthesis and antiviral activity of new dimeric inhibitors against HIV-1. | Bioorganic & medicinal chemistry 20080101 |
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