5-Aminophthalazine - CAS 102072-84-4
Catalog: |
BB000770 |
Product Name: |
5-Aminophthalazine |
CAS: |
102072-84-4 |
Synonyms: |
5-phthalazinamine; phthalazin-5-amine |
IUPAC Name: | phthalazin-5-amine |
Description: | 5-Aminophthalazine (CAS# 102072-84-4) is a building block that was used as a reactant in the synthetic preparation of ezrin inhibitors targeting metastatic osteosarcoma. |
Molecular Weight: | 145.16 |
Molecular Formula: | C8H7N3 |
Canonical SMILES: | C1=CC2=CN=NC=C2C(=C1)N |
InChI: | InChI=1S/C8H7N3/c9-8-3-1-2-6-4-10-11-5-7(6)8/h1-5H,9H2 |
InChI Key: | IXASUUHIFCTEJK-UHFFFAOYSA-N |
Boiling Point: | 423.2 °C at 760 mmHg |
Density: | 1.292 g/cm3 |
Storage: | Keep in dark place, Inert atmosphere, Room temperature |
MDL: | MFCD08272072 |
LogP: | 1.79320 |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
WO-2020108613-A1 | Heteroaromatic derivatives for use as regulator, preparation method therefor and use thereof | 20181130 |
TW-202033519-A | Heteroaromatic derivative regulator, its preparation method and application | 20181130 |
US-2021261540-A1 | Inhibitors of sarm1 | 20180607 |
EP-3301097-A2 | [1]benzothieno[3',2':4,5]imidazo[1,2-a]pyridine derivatives and related compounds for use in organic light-emitting devices (oleds) | 20160930 |
EP-3301097-B1 | [1]benzothieno[3',2':4,5]imidazo[1,2-a]pyridine derivatives and related compounds for use in organic light-emitting devices (oleds) | 20160930 |
Complexity: | 137 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 145.063997236 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 145.063997236 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 51.8 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.4 |
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Amines and Anilines
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