3-Pyrrolidinemethanol Hydrochloride - CAS 644971-22-2
Catalog: |
BB032482 |
Product Name: |
3-Pyrrolidinemethanol Hydrochloride |
CAS: |
644971-22-2 |
Synonyms: |
3-pyrrolidinylmethanol;hydrochloride; pyrrolidin-3-ylmethanol;hydrochloride |
IUPAC Name: | pyrrolidin-3-ylmethanol;hydrochloride |
Description: | 3-Pyrrolidinemethanol Hydrochloride (CAS# 644971-22-2) is used in the preparation of imidazo[1,2-a]pyridine derivatives for treatment of diseases involving fibrotic diseases, proliferative diseases, inflammatory diseases, autoimmune diseases, respiratory diseases, cardiovascular diseases, neurodegenerative diseases, and dermatologic disorder. |
Molecular Weight: | 137.61 |
Molecular Formula: | C5H12ClNO |
Canonical SMILES: | C1CNCC1CO.Cl |
InChI: | InChI=1S/C5H11NO.ClH/c7-4-5-1-2-6-3-5;/h5-7H,1-4H2;1H |
InChI Key: | RPSPXNVYBCMWAR-UHFFFAOYSA-N |
Boiling Point: | 218.1 °C at 760 mmHg |
MDL: | MFCD09800469 |
LogP: | 0.71900 |
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-10550105-B2 | Pyridazinones as PARP7 inhibitors | 20180430 |
US-2019330194-A1 | Pyridazinones as parp7 inhibitors | 20180430 |
US-2020123134-A1 | Pyridazinones as parp7 inhibitors | 20180430 |
WO-2019212937-A1 | Pyridazinones as parp7 inhibitors | 20180430 |
AU-2019262927-A1 | Pyridazinones as PARP7 inhibitors | 20180430 |
Complexity: | 56 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 2 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 137.0607417 |
Formal Charge: | 0 |
Heavy Atom Count: | 8 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 3 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 137.0607417 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 32.3 Å2 |
Undefined Atom Stereocenter Count: | 1 |
Undefined Bond Stereocenter Count: | 0 |
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Pyrrolidines
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