Methyl 2-chloro-6-methylpyrimidine-4-carboxylate - CAS 89793-11-3
Catalog: |
BB039598 |
Product Name: |
Methyl 2-chloro-6-methylpyrimidine-4-carboxylate |
CAS: |
89793-11-3 |
Synonyms: |
methyl 2-chloro-6-methylpyrimidine-4-carboxylate |
IUPAC Name: | methyl 2-chloro-6-methylpyrimidine-4-carboxylate |
Description: | Methyl 2-chloro-6-methylpyrimidine-4-carboxylate (CAS# 89793-11-3) is a useful research chemical. |
Molecular Weight: | 186.60 |
Molecular Formula: | C7H7ClN2O2 |
Canonical SMILES: | CC1=NC(=NC(=C1)C(=O)OC)Cl |
InChI: | InChI=1S/C7H7ClN2O2/c1-4-3-5(6(11)12-2)10-7(8)9-4/h3H,1-2H3 |
InChI Key: | ZNPORLVPCMFKOR-UHFFFAOYSA-N |
Boiling Point: | 306.5 ℃ at 760 mmHg |
Melting Point: | 111-113 ℃ |
Purity: | 95 % |
Density: | 1.314 g/cm3 |
Appearance: | Pale yellow needles |
MDL: | MFCD00117906 |
LogP: | 1.22500 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
US-2021053961-A1 | Substituted benzyl-triazole compounds for cbl-b inhibition, and further uses thereof | 20190626 |
WO-2020264398-A1 | Substituted benzyl-triazole compounds for cbl-b inhibition, and further uses thereof | 20190626 |
WO-2020230134-A1 | Acss2 inhibitors and methods of use thereof | 20190514 |
WO-2020138271-A1 | HETEROCYCLIC DERIVATIVES AS Nav1.7 and Nav1.8 BLOCKERS | 20181226 |
CN-113164461-A | Heterocyclic derivatives as Nav1.7 and Nav1.8 blockers | 20181226 |
Complexity: | 177 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 186.0196052 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 186.0196052 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 52.1 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.8 |
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