| CAS Number | 172846-36-5 |
| Catalog Number | AG007CBE(AGN-PC-0N7LFB) |
| Chemical Name | Carbamic acid, (6-iodohexyl)-, 1,1-dimethylethyl ester |
| IUPAC Name | tert-butyl N-(6-iodohexyl)carbamate |
| InChI | InChI=1S/C11H22INO2/c1-11(2,3)15-10(14)13-9-7-5-4-6-8-12/h4-9H2,1-3H3,(H,13,14) |
| InChI Key | LOAMYYKULCCZAM-UHFFFAOYSA-N |
| MDL Number | MFCD09951827 |
| Molecular Formula | C11H22INO2 |
| Molecular Weight | 327.2024 |
| SMILES | ICCCCCCNC(=O)OC(C)(C)C |
| Synonyms | 172846-36-5,
Tert-butyl N-(6-iodohexyl)carbamate,
TERT-BUTYL 6-IODOHEXYLCARBAMATE,
tert-Butyl (6-iodohexyl)carbamate,
Carbamic acid, (6-iodohexyl)-, 1,1-dimethylethyl ester,
SCHEMBL1616400,
CTK0E4425,
DTXSID00442582,
LOAMYYKULCCZAM-UHFFFAOYSA-N,
ZINC39092089,
6-Iodohexyl(tert-butoxycarbonyl)amine,
AKOS030572221,
N-tert-butoxycarbonyl-6-amino-1-iodohexane,
A1-05551,
(6-iodohexyl)-carbamic acid 1,1-dimethylethyl ester,
n-boc-6-iodohexylamine,
CID10616156,
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| Complexity | 178 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 327.07g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 327.206g/mol |
| Monoisotopic Mass | 327.07g/mol |
| Rotatable Bond Count | 8 |
| Topological Polar Surface Area | 38.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 4 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
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