4,4'-Biphenyldicarbonitrile - CAS 1591-30-6
Catalog: |
BB011497 |
Product Name: |
4,4'-Biphenyldicarbonitrile |
CAS: |
1591-30-6 |
Synonyms: |
4-(4-cyanophenyl)benzonitrile |
IUPAC Name: | 4-(4-cyanophenyl)benzonitrile |
Description: | 4,4'-Biphenyldicarbonitrile (CAS# 1591-30-6) is a useful research chemical. |
Molecular Weight: | 204.23 |
Molecular Formula: | C14H8N2 |
Canonical SMILES: | C1=CC(=CC=C1C#N)C2=CC=C(C=C2)C#N |
InChI: | InChI=1S/C14H8N2/c15-9-11-1-5-13(6-2-11)14-7-3-12(10-16)4-8-14/h1-8H |
InChI Key: | KAXYYLCSSXFXKR-UHFFFAOYSA-N |
Boiling Point: | 403.5 ℃ at 760 mmHg |
Purity: | 95 % |
Density: | 1.2 g/cm3 |
Appearance: | White to tan solid |
MDL: | MFCD00013805 |
LogP: | 3.09696 |
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, P312, P322, P330, P363, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
CN-112110869-A | Preparation method of HDI trimer with low free monomer content | 20200925 |
JP-2021137697-A | Cyclic compound separation or purification methods, cyclic compound production methods, separators, and separators | 20200302 |
KR-20210044160-A | Pervaporation composite membranes using covalent triazine framework for alcohol recovery | 20191011 |
CN-112023884-A | Aminoxime-based porous skeleton material, preparation method thereof and application thereof in adsorption separation of uranium ions | 20190604 |
KR-102156531-B1 | Method Of Synthesizing A Covalent Triazine Framework And A Covalent Triazine Framework Synthesized According To The Method | 20190419 |
PMID | Publication Date | Title | Journal |
22412497 | 20120301 | 2-(Biphenyl-4-yl)propan-2-ol | Acta crystallographica. Section E, Structure reports online |
Complexity: | 279 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 204.068748264 |
Formal Charge: | 0 |
Heavy Atom Count: | 16 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 204.068748264 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 47.6 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.8 |
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