2,4-Dihydroxy-5-methoxybenzaldehyde - CAS 51061-83-7
Catalog: |
BB027311 |
Product Name: |
2,4-Dihydroxy-5-methoxybenzaldehyde |
CAS: |
51061-83-7 |
Synonyms: |
2,4-dihydroxy-5-methoxybenzaldehyde |
IUPAC Name: | 2,4-dihydroxy-5-methoxybenzaldehyde |
Description: | 2,4-Dihydroxy-5-methoxybenzaldehyde (CAS# 51061-83-7) is a useful research chemical. |
Molecular Weight: | 168.15 |
Molecular Formula: | C8H8O4 |
Canonical SMILES: | COC1=C(C=C(C(=C1)C=O)O)O |
InChI: | InChI=1S/C8H8O4/c1-12-8-2-5(4-9)6(10)3-7(8)11/h2-4,10-11H,1H3 |
InChI Key: | ZFZAFNQYRZGWNK-UHFFFAOYSA-N |
Boiling Point: | 350.7 °C at 760 mmHg |
Purity: | 95 % |
Density: | 1.378 g/cm3 |
MDL: | MFCD07626333 |
LogP: | 0.91890 |
GHS Hazard Statement: | H317 (100%): May cause an allergic skin reaction [Warning Sensitization, Skin]; H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation] |
Precautionary Statement: | P261, P264+P265, P272, P280, P302+P352, P305+P351+P338, P321, P333+P313, P337+P317, P362+P364, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
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Complexity: | 159 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 168.04225873 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 168.04225873 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 66.8 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.2 |
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