Methyl 3-(2-Pyrrolyl)propionate - CAS 69917-80-2
Catalog: |
BB034016 |
Product Name: |
Methyl 3-(2-Pyrrolyl)propionate |
CAS: |
69917-80-2 |
Synonyms: |
3-(1H-pyrrol-2-yl)propanoic acid methyl ester; methyl 3-(1H-pyrrol-2-yl)propanoate |
IUPAC Name: | methyl 3-(1H-pyrrol-2-yl)propanoate |
Description: | Methyl 3-(2-Pyrrolyl)propionate (CAS# 69917-80-2) is a compound useful in organic synthesis. |
Molecular Weight: | 153.18 |
Molecular Formula: | C8H11NO2 |
Canonical SMILES: | COC(=O)CCC1=CC=CN1 |
InChI: | InChI=1S/C8H11NO2/c1-11-8(10)5-4-7-3-2-6-9-7/h2-3,6,9H,4-5H2,1H3 |
InChI Key: | UBOXXEGSGUIRAJ-UHFFFAOYSA-N |
MDL: | MFCD09841003 |
LogP: | 1.12030 |
Publication Number | Title | Priority Date |
KR-20210106496-A | conjugate | 20181218 |
US-2020072711-A1 | Fluorescent endoplasmic reticulum trackers for live cell imaging of pathogenic yeast | 20180828 |
US-2020345862-A1 | Transition metal-based functional moieties for preparing cell targeting conjugates | 20171219 |
US-2021113712-A1 | Methods for preparing cell targeting conjugates and conjugates obtainable by said methods | 20171219 |
US-2019210960-A1 | Ketone inhibitors of lysine gingipain | 20160916 |
Complexity: | 136 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 153.078978594 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 153.078978594 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 42.1 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.8 |
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