2,2-Difluorobenzodioxol-5-ol - CAS 1211539-82-0
Catalog: |
BB062955 |
Product Name: |
2,2-Difluorobenzodioxol-5-ol |
CAS: |
1211539-82-0 |
Synonyms: |
2,2-Difluoro-1,3-benzodioxol-5-ol; 2,2-Difluoro-1,3-dioxaindan-5-ol;2,2-Difluoro-2H-1,3-benzodioxol-5-ol; 2,2-Difluoro-5-hydroxybenzodioxolane;2,2-Difluorobenzo[d][1,3]dioxol-5-ol |
IUPAC Name: | 2,2-difluoro-1,3-benzodioxol-5-ol |
Description: | 2,2-Difluorobenzodioxol-5-ol is used in the preparation of isobenzofuro[6,5-f][1,3]benzodioxolones as small molecule inhibitor of insulin-like growth factor-1 receptor. |
Molecular Weight: | 174.1 |
Molecular Formula: | C7H4O3F2 |
Canonical SMILES: | C1=CC2=C(C=C1O)OC(O2)(F)F |
InChI: | InChI=1S/C7H4F2O3/c8-7(9)11-5-2-1-4(10)3-6(5)12-7/h1-3,10H |
InChI Key: | GEHVTOIGEVNIEQ-UHFFFAOYSA-N |
References: | Wang, Yingjie. et al., Faming Zhuanli Shenqing. 23 pp. (2020). |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 |
Signal Word: | Warning |
Complexity: | 186 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 174.01285031 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 174.01285031 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 38.7Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.1 |
Online Inquiry
Customer Support
Customer Centered
Related Functional Groups
Other Building Blocks
Customers Also Viewed
INDUSTRY LEADERS TRUST OUR PRODUCTS