1-(4-Fluorophenyl)-1h-imidazole-5-carboxylic acid - CAS 851721-89-6
Catalog: |
BB064738 |
Product Name: |
1-(4-Fluorophenyl)-1h-imidazole-5-carboxylic acid |
CAS: |
851721-89-6 |
Synonyms: |
1-(4-fluorophenyl)-1H-imidazole-5-carboxylic acid; 3-(4-fluorophenyl)imidazole-4-carboxylic Acid |
IUPAC Name: | 3-(4-fluorophenyl)imidazole-4-carboxylic acid |
Description: | 1-(4-Fluorophenyl)-1h-imidazole-5-carboxylic acid |
Molecular Weight: | 206.17 |
Molecular Formula: | C10H7FN2O2 |
Canonical SMILES: | C1=CC(=CC=C1N2C=NC=C2C(=O)O)F |
InChI: | InChI=1S/C10H7FN2O2/c11-7-1-3-8(4-2-7)13-6-12-5-9(13)10(14)15/h1-6H,(H,14,15) |
InChI Key: | FNLCJIQJPGSGMV-UHFFFAOYSA-N |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 |
Signal Word: | Warning |
Complexity: | 242 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 206.04915563 |
Formal Charge: | 0 |
Heavy Atom Count: | 15 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 206.04915563 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 55.1Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.6 |
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