4-(1H-Imidazol-1-yl)benzaldehyde - CAS 10040-98-9
Catalog: |
BB000218 |
Product Name: |
4-(1H-Imidazol-1-yl)benzaldehyde |
CAS: |
10040-98-9 |
Synonyms: |
4-imidazol-1-ylbenzaldehyde |
IUPAC Name: | 4-imidazol-1-ylbenzaldehyde |
Description: | 4-(1H-Imidazol-1-yl)benzaldehyde (CAS# 10040-98-9) is a useful research chemical. |
Molecular Weight: | 172.18 |
Molecular Formula: | C10H8N2O |
Canonical SMILES: | C1=CC(=CC=C1C=O)N2C=CN=C2 |
InChI: | InChI=1S/C10H8N2O/c13-7-9-1-3-10(4-2-9)12-6-5-11-8-12/h1-8H |
InChI Key: | DCICUQFMCRPKHZ-UHFFFAOYSA-N |
Boiling Point: | 351.1 °C at 760 mmHg |
Melting Point: | 153-155 °C |
Purity: | 95 % |
Density: | 1.15 g/cm3 |
Appearance: | White to tan solid |
Storage: | Inert atmosphere, 2-8 °C |
MDL: | MFCD00209977 |
LogP: | 1.68480 |
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 |
CN-113078340-A | Polysulfone/polyvinyl alcohol composite anion exchange membrane and preparation method thereof | 20210409 |
CN-112581856-A | Temperature indicating label | 20201229 |
WO-2021203016-A2 | Protein-protein interaction stabilizers | 20200403 |
WO-2020253870-A1 | 6-hydrazinoadenosine compound having a2a adenosine receptor agonist activity | 20190621 |
WO-2020253872-A1 | 2-benzylidene hydrazinoadenosine compounds having a2a adenosine receptor agnostic activity | 20190621 |
PMID | Publication Date | Title | Journal |
19664864 | 20091101 | Anti-oxidant, anti-fungal and anti-leishmanial activities of novel 3-[4-(1H-imidazol-1-yl) phenyl]prop-2-en-1-ones | European journal of medicinal chemistry |
Complexity: | 176 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 172.063662883 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 172.063662883 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 34.9 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.1 |
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