N-Boc-2-iodoaniline - CAS 161117-84-6
Catalog: |
BB011702 |
Product Name: |
N-Boc-2-iodoaniline |
CAS: |
161117-84-6 |
Synonyms: |
tert-butyl N-(2-iodophenyl)carbamate |
IUPAC Name: | tert-butyl N-(2-iodophenyl)carbamate |
Description: | N-Boc-2-iodoaniline (CAS# 161117-84-6 ) is a useful research chemical. |
Molecular Weight: | 319.14 |
Molecular Formula: | C11H14INO2 |
Canonical SMILES: | CC(C)(C)OC(=O)NC1=CC=CC=C1I |
InChI: | InChI=1S/C11H14INO2/c1-11(2,3)15-10(14)13-9-7-5-4-6-8(9)12/h4-7H,1-3H3,(H,13,14) |
InChI Key: | PPYKNLRMZVGYQL-UHFFFAOYSA-N |
Boiling Point: | 85-95 °C / 0.5 mmHg (lit.) |
Density: | 1.277 g/mL at 25 °C(lit.) |
Appearance: | White to yellow or colorless to yellow solid |
MDL: | MFCD07369726 |
LogP: | 3.71120 |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P270, P271, P273, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P391, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
CN-110878034-A | Method for preparing amine compound by base-catalyzed decarboxylation amination | 20190829 |
TW-201946621-A | Anti-light composition containing malassezia-derived compound and / or chemical analogue thereof | 20180412 |
US-2019345140-A1 | Photoprotective compositions containing malassezia-derived compounds and/or chemical analogs thereof | 20180412 |
WO-2019200232-A1 | Photoprotective compositions containing malassezia-derived compounds and/or chemical analogs thereof | 20180412 |
AU-2019251579-A1 | Photoprotective compositions containing Malassezia-derived compounds and/or chemical analogs thereof | 20180412 |
PMID | Publication Date | Title | Journal |
21375315 | 20110401 | Total syntheses of (-)- and (+)-goniomitine | Organic letters |
Complexity: | 225 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 319.00693 |
Formal Charge: | 0 |
Heavy Atom Count: | 15 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 319.00693 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 38.3 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.4 |
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