4-Nitrophenyl iodoacetate - CAS 31252-85-4
Catalog: |
BB020843 |
Product Name: |
4-Nitrophenyl iodoacetate |
CAS: |
31252-85-4 |
Synonyms: |
(4-nitrophenyl) 2-iodoacetate |
IUPAC Name: | (4-nitrophenyl) 2-iodoacetate |
Description: | A sulfhydryl reactive compound. |
Molecular Weight: | 307.04 |
Molecular Formula: | C8H6INO4 |
Canonical SMILES: | C1=CC(=CC=C1[N+](=O)[O-])OC(=O)CI |
InChI: | InChI=1S/C8H6INO4/c9-5-8(11)14-7-3-1-6(2-4-7)10(12)13/h1-4H,5H2 |
InChI Key: | GERXSZLDSOPHJV-UHFFFAOYSA-N |
Boiling Point: | 383.8 °C at 760 mmHg |
Density: | 1.946 g/cm3 |
Appearance: | Greenish-brown crystals |
MDL: | MFCD00042813 |
LogP: | 2.45840 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
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PMID | Publication Date | Title | Journal |
22403485 | 20120101 | Targeted delivery of Tet1 peptide functionalized polymersomes to the rat cochlear nerve | International journal of nanomedicine |
21579806 | 20100116 | [3-(Iodo-acetamido)prop-yl]triphenyl-phospho-nium tetra-phenyl-borate | Acta crystallographica. Section E, Structure reports online |
Complexity: | 220 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 306.93416 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 306.93416 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 72.1 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.2 |
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