2-Amino-5-iodopyrimidine - CAS 1445-39-2
Catalog: |
BB009787 |
Product Name: |
2-Amino-5-iodopyrimidine |
CAS: |
1445-39-2 |
Synonyms: |
5-iodo-2-pyrimidinamine; 5-iodopyrimidin-2-amine |
IUPAC Name: | 5-iodopyrimidin-2-amine |
Description: | 2-Amino-5-iodopyrimidine (CAS# 1445-39-2) is used as a reactant in the synthesis of aminopyrimidine and cyclic guanidine amino acids. |
Molecular Weight: | 221.00 |
Molecular Formula: | C4H4IN3 |
Canonical SMILES: | C1=C(C=NC(=N1)N)I |
InChI: | InChI=1S/C4H4IN3/c5-3-1-7-4(6)8-2-3/h1-2H,(H2,6,7,8) |
InChI Key: | HAFKCGZQRIIADX-UHFFFAOYSA-N |
Boiling Point: | 364.9 °C at 760 mmHg |
Density: | 2.204 g/cm3 |
MDL: | MFCD01075666 |
LogP: | 1.24460 |
GHS Hazard Statement: | H302 (88.64%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P310, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Danger |
Publication Number | Title | Priority Date |
JP-2020189891-A | Harmful arthropod control method using heterocyclic compound | 20200831 |
WO-2021165346-A1 | Gcn2 modulator compounds | 20200217 |
WO-2021147879-A1 | Shp2 inhibitor and application thereof | 20200121 |
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WO-2020203763-A1 | Heterocyclic compound and harmful arthropod pest control composition containing same | 20190329 |
PMID | Publication Date | Title | Journal |
21579532 | 20100526 | 5-Iodo-pyrimidin-2-amine | Acta crystallographica. Section E, Structure reports online |
Complexity: | 69.7 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 220.94499 |
Formal Charge: | 0 |
Heavy Atom Count: | 8 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 220.94499 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 51.8 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.5 |
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Amines and Anilines
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