2,6-Difluoro-4-methylbenzaldehyde - CAS 1201597-22-9
Catalog: |
BB004733 |
Product Name: |
2,6-Difluoro-4-methylbenzaldehyde |
CAS: |
1201597-22-9 |
Synonyms: |
2,6-difluoro-4-methylbenzaldehyde; 2,6-difluoro-4-methylbenzaldehyde |
IUPAC Name: | 2,6-difluoro-4-methylbenzaldehyde |
Description: | 2,6-Difluoro-4-methylbenzaldehyde (CAS# 1201597-22-9) is a useful research chemical. |
Molecular Weight: | 156.13 |
Molecular Formula: | C8H6F2O |
Canonical SMILES: | CC1=CC(=C(C(=C1)F)C=O)F |
InChI: | InChI=1S/C8H6F2O/c1-5-2-7(9)6(4-11)8(10)3-5/h2-4H,1H3 |
InChI Key: | BQVVPJZIUSQOAU-UHFFFAOYSA-N |
Storage: | Inert atmosphere, 2-8 ℃ |
LogP: | 2.08570 |
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 |
WO-2018048969-A1 | Multi-targeted heterocyclic compounds for the treatment of neurodegenerative diseases | 20160909 |
US-10647724-B2 | Selective estrogen receptor degraders and uses thereof | 20160205 |
US-2020040001-A1 | Selective estrogen receptor degraders and uses thereof | 20160205 |
US-10029983-B2 | Urea derivative or pharmacologically acceptable salt thereof | 20131128 |
US-10252992-B2 | Urea derivative or pharmacologically acceptable salt thereof | 20131128 |
Complexity: | 137 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 156.03867113 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 156.03867113 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 17.1 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.9 |
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