2-Chloro-5-fluoro-N-methylpyrimidin-4-amine - CAS 67316-43-2
Catalog: |
BB033244 |
Product Name: |
2-Chloro-5-fluoro-N-methylpyrimidin-4-amine |
CAS: |
67316-43-2 |
Synonyms: |
2-chloro-5-fluoro-N-methylpyrimidin-4-amine |
IUPAC Name: | 2-chloro-5-fluoro-N-methylpyrimidin-4-amine |
Description: | 2-Chloro-5-fluoro-N-methylpyrimidin-4-amine (CAS# 67316-43-2) is a useful research chemical. |
Molecular Weight: | 161.56 |
Molecular Formula: | C5H5ClFN3 |
Canonical SMILES: | CNC1=NC(=NC=C1F)Cl |
InChI: | InChI=1S/C5H5ClFN3/c1-8-4-3(7)2-9-5(6)10-4/h2H,1H3,(H,8,9,10) |
InChI Key: | VYADLELCFPIRRE-UHFFFAOYSA-N |
Boiling Point: | 306.6 °C at 760 mmHg |
Density: | 1.448 g/cm3 |
MDL: | MFCD01346699 |
LogP: | 1.38380 |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]; H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]; H318 (100%): Causes serious eye damage [Danger 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+P354+P338, P317, P319, P321, P330, P332+P317, P362+P364, P403+P233, P405, and P501 |
Signal Word: | Danger |
Publication Number | Title | Priority Date |
WO-2020103884-A1 | Cyclic Ureas | 20181120 |
CN-113302183-A | Cyclic ureas | 20181120 |
EP-3883925-A1 | Cyclic ureas | 20181120 |
KR-20210106441-A | cyclic urea | 20181120 |
US-2021292305-A1 | Cyclic Ureas | 20181120 |
Complexity: | 113 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 161.015603 |
Formal Charge: | 0 |
Heavy Atom Count: | 10 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 161.015603 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 37.8 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.6 |
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