Cas no 62224-12-8 (Benzene, 5-iodo-1,3-bis(methoxymethyl)-2-methyl-)
62224-12-8 structure
Product Name:Benzene, 5-iodo-1,3-bis(methoxymethyl)-2-methyl-
CAS No:62224-12-8
MF:C11H15IO2
MW:306.140075922012
CID:453704
PubChem ID:71388614
Update Time:2025-04-19
Benzene, 5-iodo-1,3-bis(methoxymethyl)-2-methyl- Chemical and Physical Properties
Names and Identifiers
-
- Benzene, 5-iodo-1,3-bis(methoxymethyl)-2-methyl-
- 5-iodo-1,3-bis(methoxymethyl)-2-methylbenzene
- 62224-12-8
- DTXSID70810673
-
- Inchi： 1S/C11H15IO2/c1-8-9(6-13-2)4-11(12)5-10(8)7-14-3/h4-5H,6-7H2,1-3H3
- InChI Key： UQMFTOBZSPXMIA-UHFFFAOYSA-N
- SMILES： IC1C=C(COC)C(C)=C(C=1)COC
Computed Properties
- Exact Mass: 306.01125
- Monoisotopic Mass: 306.01168g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 14
- Rotatable Bond Count: 4
- Complexity: 147
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 2.2
- Topological Polar Surface Area: 18.5?2
Experimental Properties
- PSA: 18.46
Benzene, 5-iodo-1,3-bis(methoxymethyl)-2-methyl- Related Literature
-
Fereshteh Bayat Environ. Sci.: Nano, 2021,8, 367-389
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Ross Harder,David C. Dunand,Ian McNulty Nanoscale, 2017,9, 5686-5693
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Domenico Lombardo,Gianmarco Munaò,Pietro Calandra,Luigi Pasqua,Maria Teresa Caccamo Phys. Chem. Chem. Phys., 2019,21, 11983-11991
62224-12-8 (Benzene, 5-iodo-1,3-bis(methoxymethyl)-2-methyl-) Related Products
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