4-Amino-6-phenylpyrimidine - CAS 3435-29-8
Catalog: |
BB022086 |
Product Name: |
4-Amino-6-phenylpyrimidine |
CAS: |
3435-29-8 |
Synonyms: |
6-phenyl-4-pyrimidinamine; 6-phenylpyrimidin-4-amine |
IUPAC Name: | 6-phenylpyrimidin-4-amine |
Description: | 4-Amino-6-phenylpyrimidine (CAS# 3435-29-8) is a useful research chemical. |
Molecular Weight: | 171.20 |
Molecular Formula: | C10H9N3 |
Canonical SMILES: | C1=CC=C(C=C1)C2=CC(=NC=N2)N |
InChI: | InChI=1S/C10H9N3/c11-10-6-9(12-7-13-10)8-4-2-1-3-5-8/h1-7H,(H2,11,12,13) |
InChI Key: | NYXYYBHDSNBGOS-UHFFFAOYSA-N |
Boiling Point: | 388.2 °C at 760 mmHg |
Density: | 1.193 g/cm3 |
Appearance: | Solid |
LogP: | 2.30700 |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]; H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]; H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]; H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation] |
Precautionary Statement: | P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
CN-112010844-A | Preparation method and application of N- (pyrimidine-2-yl) coumarin-7-amine derivative as protein kinase inhibitor | 20190531 |
EP-3712145-A1 | Condensed cyclic compound and organic light-emitting device including such compound | 20190319 |
EP-3670520-A1 | Organometallic compound, organic light-emitting device including the organometallic compound, and diagnostic composition including the organometallic compound | 20181219 |
WO-2018103058-A1 | Inhibitors of bruton's tyrosine kinase and methods of their use | 20161209 |
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 |
PMID | Publication Date | Title | Journal |
15582439 | 20050103 | Amino-substituted heterocycles as isosteres of trans-cinnamides: design and synthesis of heterocyclic biaryl sulfides as potent antagonists of LFA-1/ICAM-1 binding | Bioorganic & medicinal chemistry letters |
Complexity: | 154 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 171.0796473 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 171.0796473 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 51.8 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.5 |
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