(±)-trans-1,2-Cyclopentanediol - CAS 5057-99-8
Catalog: |
BB027118 |
Product Name: |
(±)-trans-1,2-Cyclopentanediol |
CAS: |
5057-99-8 |
Synonyms: |
(1R,2R)-cyclopentane-1,2-diol |
IUPAC Name: | (1R,2R)-cyclopentane-1,2-diol |
Description: | (±)-trans-1,2-Cyclopentanediol (CAS# 5057-99-8) is a building block for the synthesis of chiral phosphine ligands. It can also be used to prepare benzoquinolines and benzoindoles via heterocyclization of naphthylamines with diols catalyzed by iridium chloride/BINAP. |
Molecular Weight: | 102.13 |
Molecular Formula: | C5H10O2 |
Canonical SMILES: | C1CC(C(C1)O)O |
InChI: | InChI=1S/C5H10O2/c6-4-2-1-3-5(4)7/h4-7H,1-3H2/t4-,5-/m1/s1 |
InChI Key: | VCVOSERVUCJNPR-RFZPGFLSSA-N |
Boiling Point: | 136 °C / 21.5 mmHg (lit.) |
Density: | 1.235 g/cm3 |
Appearance: | Off-white crystalline powder |
MDL: | MFCD00082582 |
LogP: | -0.10790 |
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-2020353105-A1 | Macrocyclic Chelators and Methods of Use Thereof | 20190510 |
WO-2020229974-A1 | Macrocyclic chelators and methods of use thereof | 20190510 |
US-2020017461-A1 | 3-(5-hydroxy-1-oxoisoindolin-2-yl)piperidine-2,6-dione derivatives and uses thereof | 20180710 |
BR-112020026947-A2 | DERIVATIVES OF 3- (5-HYDROXY-1-OXOISOINDOLIN-2-IL) PIPERIDIN-2,6-DIONA AND ITS USE IN THE TREATMENT OF ZINC FINGER-RELATED DISEASES OF THE IKAROS 2 FAMILY (IKZF2) | 20180710 |
CN-112261970-A | 3- (5-hydroxy-1-oxoisoindolin-2-yl) piperidine-2, 6-dione derivatives and their use in the treatment of IKAROS family Zinc finger 2(IKZF2) dependent diseases | 20180710 |
PMID | Publication Date | Title | Journal |
17713957 | 20070928 | Lipase-catalyzed kinetic resolution of cyclic trans-1,2-diols bearing a diester moiety: synthetic application to chiral seven-membered-ring alpha,alpha-disubstituted alpha-amino acid | The Journal of organic chemistry |
Complexity: | 55.1 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 2 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 102.068079557 |
Formal Charge: | 0 |
Heavy Atom Count: | 7 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 102.068079557 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 40.5 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | -0.1 |
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