2,3-Difluoro-4-methoxybenzaldehyde - CAS 256417-11-5
Catalog: |
BB018987 |
Product Name: |
2,3-Difluoro-4-methoxybenzaldehyde |
CAS: |
256417-11-5 |
Synonyms: |
2,3-difluoro-4-methoxybenzaldehyde; 2,3-difluoro-4-methoxybenzaldehyde |
IUPAC Name: | 2,3-difluoro-4-methoxybenzaldehyde |
Description: | 2,3-Difluoro-4-methoxybenzaldehyde (CAS# 256417-11-5) is a useful research chemical. |
Molecular Weight: | 172.13 |
Molecular Formula: | C8H6F2O2 |
Canonical SMILES: | COC1=C(C(=C(C=C1)C=O)F)F |
InChI: | InChI=1S/C8H6F2O2/c1-12-6-3-2-5(4-11)7(9)8(6)10/h2-4H,1H3 |
InChI Key: | UBBBLLSKHCENQZ-UHFFFAOYSA-N |
Boiling Point: | 235.7 °C at 760 mmHg |
Purity: | 98 % |
Density: | 1.289 g/cm3 |
MDL: | MFCD04115981 |
LogP: | 1.78590 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]; H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]; H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract 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 |
CN-113429270-A | Styrene derivative and preparation method thereof, modified organic silicon resin and preparation method and application thereof | 20210624 |
WO-2021108023-A1 | Penicillin-binding protein inhibitors | 20191126 |
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CN-110382494-A | Pyrazolo [1,5-A] pyridine compounds being substituted are as RET kinase inhibitor | 20161010 |
Complexity: | 163 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 172.03358575 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 172.03358575 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 26.3 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.6 |
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