Naphthalene-2-carbonitrile - CAS 613-46-7
Catalog: |
BB031067 |
Product Name: |
Naphthalene-2-carbonitrile |
CAS: |
613-46-7 |
Synonyms: |
naphthalene-2-carbonitrile |
IUPAC Name: | naphthalene-2-carbonitrile |
Description: | Naphthalene-2-carbonitrile (CAS# 613-46-7) is a useful research chemical. |
Molecular Weight: | 153.18 |
Molecular Formula: | C11H7N |
Canonical SMILES: | C1=CC=C2C=C(C=CC2=C1)C#N |
InChI: | InChI=1S/C11H7N/c12-8-9-5-6-10-3-1-2-4-11(10)7-9/h1-7H |
InChI Key: | AZKDTTQQTKDXLH-UHFFFAOYSA-N |
Boiling Point: | 156-158 °C / 12 mmHg |
Density: | 1.0939 g/cm3 (60 C) |
MDL: | MFCD00016807 |
LogP: | 2.71148 |
GHS Hazard Statement: | H300 (88.37%): Fatal if swallowed [Danger Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P270, P271, P280, P301+P310, P302+P352, P304+P340, P305+P351+P338, P310, P312, P321, P322, P330, P332+P313, P361, P362, P363, P403+P233, P405, and P501 |
Signal Word: | Danger |
Publication Number | Title | Priority Date |
CN-111668536-A | Preparation method of metal aluminum-cyano organic matter secondary battery | 20200527 |
CN-111668536-B | Preparation method of metal aluminum-cyano organic matter secondary battery | 20200527 |
CN-113224244-A | Light-emitting device, preparation method thereof and display device | 20200410 |
KR-20210078402-A | Amorphous catalyst, method for preparing the amorphous catalyst, and catalyst for preparing methyl methacrylate comprising the amorphous catalyst | 20191218 |
DE-102019109445-A1 | Process for the production of aromatic carbonitriles | 20190410 |
PMID | Publication Date | Title | Journal |
21491040 | 20110901 | Efficient and selective photodimerization of 2-naphthalenecarbonitrile mediated by cucurbit[8]uril in an aqueous solution | Photochemical & photobiological sciences : Official journal of the European Photochemistry Association and the European Society for Photobiology |
21512704 | 20110901 | Hydrogen-bonding directed, regioselective photocycloaddition reactions of cyanonaphthalenes with furanmethanols | Photochemical & photobiological sciences : Official journal of the European Photochemistry Association and the European Society for Photobiology |
20570527 | 20100701 | Synthesis and anti-HIV activity of 2-naphthyl substituted DAPY analogues as non-nucleoside reverse transcriptase inhibitors | Bioorganic & medicinal chemistry |
21302561 | 20100101 | Mechanisms of formation of nitrogen-containing polycyclic aromatic compounds in low-temperature environments of planetary atmospheres: a theoretical study | Faraday discussions |
18693765 | 20080919 | Formation of cubane-like photodimers from 2-naphthalenecarbonitrile | The Journal of organic chemistry |
Complexity: | 200 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 153.057849228 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 153.057849228 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 23.8 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.2 |
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