| CAS Number | 105542-98-1 |
| Catalog Number | AG007W4L(AGN-PC-00H44G) |
| Chemical Name | Bicyclo[1.1.1]pentane, 1,3-diiodo- |
| IUPAC Name | 1,3-diiodobicyclo[1.1.1]pentane |
| InChI | InChI=1S/C5H6I2/c6-4-1-5(7,2-4)3-4/h1-3H2 |
| InChI Key | JJWNAOGSAYBEPB-UHFFFAOYSA-N |
| MDL Number | MFCD29037325 |
| Molecular Formula | C5H6I2 |
| Molecular Weight | 319.9101 |
| SMILES | IC12CC(C1)(C2)I |
| Synonyms | 1,3-diiodobicyclo[1.1.1]pentane,
105542-98-1,
Bicyclo[1.1.1]pentane, 1,3-diiodo-,
ACMC-20m8ez,
SCHEMBL9143556,
CTK0G5354,
DTXSID70474239,
MFCD29037325,
AKOS024255989,
ZINC137856203,
FCH3466702,
KS-000008U5,
OR312447,
TZ001227,
CS-0047433,
CID11834162,
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| Complexity | 79.2 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 319.856g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 7 |
| Hydrogen Bond Acceptor Count | 0 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 319.912g/mol |
| Monoisotopic Mass | 319.856g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 0A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.1 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number