2-[(2s)-Oxolan-2-yl]acetic Acid - CAS 1240504-10-2
Catalog: |
BB058504 |
Product Name: |
2-[(2s)-Oxolan-2-yl]acetic Acid |
CAS: |
1240504-10-2 |
Synonyms: |
(2S)-Tetrahydro-2-furanacetic Acid;(S)-(Tetrahydrofuran-2-yl)acetic Acid;(S)-2-(Tetrahydrofuran-2-yl)acetic Acid |
IUPAC Name: | 2-[(2S)-oxolan-2-yl]acetic acid |
Description: | 2-[(2S)-oxolan-2-yl]acetic acid (cas# 1240504-10-2) is a useful research chemical. It is used in the preparation of heteroaryl substituted pyridines for treatment of cystic fibrosis. |
Molecular Weight: | 130.14 |
Molecular Formula: | C6H10O3 |
Canonical SMILES: | C1CC(OC1)CC(=O)O |
InChI: | InChI=1S/C6H10O3/c7-6(8)4-5-2-1-3-9-5/h5H,1-4H2,(H,7,8)/t5-/m0/s1 |
InChI Key: | IEDVQOXHVRVPIX-YFKPBYRVSA-N |
References: | Altenbach, R. J., et al. PCT Int. Appl. (2017), WO 2017208115 A1 20171207. |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
CA-3022216-A1 | Heteroaryl substituted pyridines and methods of use | 20160603 |
EP-3464282-B1 | Heteroaryl substituted pyridines and methods of use | 20160603 |
JP-2019517455-A | Heteroaryl-substituted pyridines and methods of use | 20160603 |
KR-20190015215-A | Heteroaryl substituted pyridines and methods of use | 20160603 |
TW-201802085-A | Heteroaryl substituted pyridine and method of use | 20160603 |
US-10138227-B2 | Heteroaryl substituted pyridines and methods of use | 20160603 |
US-10604515-B2 | Heteroaryl substituted pyridines and methods of use | 20160603 |
US-2017349576-A1 | Heteroaryl substituted pyridines and methods of use | 20160603 |
US-2019055229-A1 | Heteroaryl Substituted Pyridines and Methods of Use | 20160603 |
ES-2806873-T3 | Heteroaryl substituted pyridines and methods of use | 20160603 |
Complexity: | 111 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 1 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 130.062994177 |
Formal Charge: | 0 |
Heavy Atom Count: | 9 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 130.062994177 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 46.5Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.1 |
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