methyl 3-methoxypyrrolidine-3-carboxylate - CAS 942190-66-1
Catalog: |
BB041231 |
Product Name: |
methyl 3-methoxypyrrolidine-3-carboxylate |
CAS: |
942190-66-1 |
Synonyms: |
3-methoxy-3-pyrrolidinecarboxylic acid methyl ester; methyl 3-methoxypyrrolidine-3-carboxylate |
IUPAC Name: | methyl 3-methoxypyrrolidine-3-carboxylate |
Description: | methyl 3-methoxypyrrolidine-3-carboxylate (CAS# 942190-66-1 ) is a useful research chemical. |
Molecular Weight: | 159.185 |
Molecular Formula: | C7H13NO3 |
Canonical SMILES: | COC(=O)C1(CCNC1)OC |
InChI: | InChI=1S/C7H13NO3/c1-10-6(9)7(11-2)3-4-8-5-7/h8H,3-5H2,1-2H3 |
InChI Key: | IZCZZVPUXSQCCM-UHFFFAOYSA-N |
Boiling Point: | 199.7±40.0 °C (760 mmHg) |
Density: | 1.10±0.1 g/cm3 (20 °C, 760 mmH g) |
LogP: | -0.13330 |
Publication Number | Title | Priority Date |
AU-2009215534-A1 | Compounds that are ERK inhibitors | 20080221 |
AU-2009215534-A2 | Compounds that are ERK inhibitors | 20080221 |
AU-2009215534-B2 | Compounds that are ERK inhibitors | 20080221 |
AU-2009215534-B8 | Compounds that are ERK inhibitors | 20080221 |
CA-2714479-A1 | Compounds that are erk inhibitors | 20080221 |
Complexity: | 160 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 159.08954328 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 159.08954328 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 47.6 |
Undefined Atom Stereocenter Count: | 1 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | -0.4 |
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Pyrrolidines
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