5-Hydroxy-2-methylbenzaldehyde - CAS 23942-00-9
Catalog: |
BB044595 |
Product Name: |
5-Hydroxy-2-methylbenzaldehyde |
CAS: |
23942-00-9 |
Synonyms: |
Benzaldehyde, 5-hydroxy-2-methyl-; 2-methyl-5-hydroxybenzaldehyde |
IUPAC Name: | 5-hydroxy-2-methylbenzaldehyde |
Description: | 5-Hydroxy-2-methylbenzaldehyde (CAS# 23942-00-9 ) is a useful research chemical. |
Molecular Weight: | 136.15 |
Molecular Formula: | C8H8O2 |
Canonical SMILES: | CC1=C(C=C(C=C1)O)C=O |
InChI: | InChI=1S/C8H8O2/c1-6-2-3-8(10)4-7(6)5-9/h2-5,10H,1H3 |
InChI Key: | QONBQACIGSEEDX-UHFFFAOYSA-N |
Boiling Point: | 257.0±20.0 °C (Predicted) |
Purity: | ≥ 95 % |
Density: | 1.175±0.06 g/cm3 (Predicted) |
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 |
Complexity: | 122 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 136.052429494 |
Formal Charge: | 0 |
Heavy Atom Count: | 10 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 136.052429494 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 37.3 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.4 |
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