4,5-Diaminophthalonitrile - CAS 129365-93-1
Catalog: |
BB006982 |
Product Name: |
4,5-Diaminophthalonitrile |
CAS: |
129365-93-1 |
Synonyms: |
4,5-diaminobenzene-1,2-dicarbonitrile |
IUPAC Name: | 4,5-diaminobenzene-1,2-dicarbonitrile |
Description: | 4,5-Diaminophthalonitrile (CAS# 129365-93-1) is a useful research chemical. |
Molecular Weight: | 158.16 |
Molecular Formula: | C8H6N4 |
Canonical SMILES: | C1=C(C(=CC(=C1N)N)C#N)C#N |
InChI: | InChI=1S/C8H6N4/c9-3-5-1-7(11)8(12)2-6(5)4-10/h1-2H,11-12H2 |
InChI Key: | PCKAZQYWUDIFQM-UHFFFAOYSA-N |
Appearance: | White to very dark orange and faint brown to very dark brown and red-brown and very dark red-brown powder or crystals |
Storage: | Keep in dark place, Inert atmosphere, Room temperature |
LogP: | 1.75676 |
GHS Hazard Statement: | H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P270, P271, P280, P301+P310, 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: | Danger |
Publication Number | Title | Priority Date |
CN-113200929-A | Cyanoquinoxaline red-light thermal excitation delayed fluorescent material, and synthesis method and application thereof | 20210401 |
CN-112409364-A | Hexaazanaphthalene derivative and preparation method and application thereof | 20201111 |
CN-111808097-A | Solvent yellow 184 derivative and preparation method and application thereof | 20200714 |
JP-2021150378-A | Photodetector | 20200317 |
KR-20210083205-A | Novel organic eletron-transfer mediator and device comprising the same | 20191226 |
PMID | Publication Date | Title | Journal |
21754170 | 20110401 | 2,3-Dicyano-4-[(4-methyl-phenyl-sulfon-yl)-oxy]phenyl 4-methyl-benzene-sulfonate | Acta crystallographica. Section E, Structure reports online |
21577624 | 20090822 | 5,6-Diphenyl-pyrazine-2,3-dicarbonitrile | Acta crystallographica. Section E, Structure reports online |
21582556 | 20090325 | 4,5-Diamino-benzene-1,2-dicarbonitrile | Acta crystallographica. Section E, Structure reports online |
Complexity: | 227 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 158.059246208 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 158.059246208 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 99.6 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0 |
Online Inquiry
Customer Support
Customer Centered
Related Functional Groups
Nitrogen Compounds
Customers Also Viewed
INDUSTRY LEADERS TRUST OUR PRODUCTS