2-(2-Pyrrolidinyl)acetic Acid Hydrochloride - CAS 71985-79-0
Catalog: |
BB034508 |
Product Name: |
2-(2-Pyrrolidinyl)acetic Acid Hydrochloride |
CAS: |
71985-79-0 |
Synonyms: |
2-(2-pyrrolidinyl)acetic acid;hydrochloride; 2-pyrrolidin-2-ylacetic acid;hydrochloride |
IUPAC Name: | 2-pyrrolidin-2-ylacetic acid;hydrochloride |
Description: | 2-(2-Pyrrolidinyl)acetic Acid Hydrochloride (CAS# 71985-79-0) is the hydrochloride salf form of (+/-)-Homoproline (H605005).(+/-)-Homoproline was isolated from Melampodium divaricatum and is a GABA-uptake inhibitor derived from proline. |
Molecular Weight: | 165.62 |
Molecular Formula: | C6H12ClNO2 |
Canonical SMILES: | C1CC(NC1)CC(=O)O.Cl |
InChI: | InChI=1S/C6H11NO2.ClH/c8-6(9)4-5-2-1-3-7-5;/h5,7H,1-4H2,(H,8,9);1H |
InChI Key: | VQDACVOAOJQTPR-UHFFFAOYSA-N |
LogP: | 1.34390 |
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 |
WO-2020052631-A1 | Triazolo-pyrimidine compounds and uses thereof | 20180912 |
US-10858365-B2 | Triazolo-pyrimidine compounds and uses thereof | 20180912 |
US-2020331918-A1 | Triazolo-pyrimidine compounds and uses thereof | 20180912 |
US-2021009600-A1 | Triazolo-pyrimidine compounds and uses thereof | 20180912 |
US-10550105-B2 | Pyridazinones as PARP7 inhibitors | 20180430 |
Complexity: | 114 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 2 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 165.0556563 |
Formal Charge: | 0 |
Heavy Atom Count: | 10 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 3 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 165.0556563 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 49.3 Å2 |
Undefined Atom Stereocenter Count: | 1 |
Undefined Bond Stereocenter Count: | 0 |
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