4-Iodophthalonitrile - CAS 69518-17-8
Catalog: |
BB033854 |
Product Name: |
4-Iodophthalonitrile |
CAS: |
69518-17-8 |
Synonyms: |
4-iodobenzene-1,2-dicarbonitrile |
IUPAC Name: | 4-iodobenzene-1,2-dicarbonitrile |
Description: | 4-Iodophthalonitrile (CAS# 69518-17-8) is a useful research chemical. |
Molecular Weight: | 254.03 |
Molecular Formula: | C8H3IN2 |
Canonical SMILES: | C1=CC(=C(C=C1I)C#N)C#N |
InChI: | InChI=1S/C8H3IN2/c9-8-2-1-6(4-10)7(3-8)5-11/h1-3H |
InChI Key: | OOHQHYJZUSXMFD-UHFFFAOYSA-N |
Boiling Point: | 364.7 ℃ at 760 mmHg |
Melting Point: | 140-142 ℃ (lit.) |
Purity: | 95 % |
Density: | 1.95 g/cm3 |
Appearance: | White to tan solid |
MDL: | MFCD01863730 |
LogP: | 2.03456 |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
CN-111875794-A | Novel preparation method of nitrile resin monomer | 20200731 |
CN-111732839-A | Phthalocyanine D-pi-A type asymmetric disc dye and preparation method thereof | 20200628 |
KR-20210016781-A | Electrochromic material, manufacturing method thereof, and method for manufacturing electrochromic device comprising the same | 20190805 |
WO-2020192042-A1 | Electroluminescent material, method for preparing electroluminescent material, and light-emitting device | 20190327 |
CN-108976239-B | Preparation method and application of organic hole transport material taking phthalocyanine as core | 20180911 |
Complexity: | 231 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 253.93410 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 253.93410 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 47.6 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2 |
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