(R)-3-Pyrrolidinol - CAS 2799-21-5
Catalog: |
BB019727 |
Product Name: |
(R)-3-Pyrrolidinol |
CAS: |
2799-21-5 |
Synonyms: |
(3R)-3-pyrrolidinol; (3R)-pyrrolidin-3-ol |
IUPAC Name: | (3R)-pyrrolidin-3-ol |
Description: | (R)-3-Pyrrolidinol (CAS# 2799-21-5) is used in preparation of allosteric BCR-ABL bifunctional proteolysis targeting chimera compounds. |
Molecular Weight: | 87.12 |
Molecular Formula: | C4H9NO |
Canonical SMILES: | C1CNCC1O |
InChI: | InChI=1S/C4H9NO/c6-4-1-2-5-3-4/h4-6H,1-3H2/t4-/m1/s1 |
InChI Key: | JHHZLHWJQPUNKB-SCSAIBSYSA-N |
Boiling Point: | 215-216 °C |
Density: | 1.078 g/cm3 |
MDL: | MFCD00145220 |
LogP: | -0.33060 |
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-2016145252-A1 | Heteroaryl compounds as irak inhibitors and uses thereof | 20141120 |
US-2016120841-A1 | Substituted chromanes and method of use | 20141031 |
US-2016096827-A1 | Tank-binding kinase inhibitor compounds | 20140926 |
US-2015344473-A1 | Tank-binding kinase inhibitor compounds | 20140603 |
WO-2015179190-A1 | N-acylethanolamine hydrolyzing acid amidase (naaa) inhibitors and their use thereof | 20140519 |
Complexity: | 46.8 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 1 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 87.068413911 |
Formal Charge: | 0 |
Heavy Atom Count: | 6 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 87.068413911 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 32.3 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | -0.7 |
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