trans-2-Phenylcyclopropanecarboxylic Hydrazide - CAS 14561-40-1
Catalog: |
BB058258 |
Product Name: |
trans-2-Phenylcyclopropanecarboxylic Hydrazide |
CAS: |
14561-40-1 |
Synonyms: |
trans-2-Phenyl-cyclopropanecarboxylic Acid Hydrazide; (1R,2R)-rel-2-Phenyl-ayclopropanecarboxyl ic Acid Hydrazide |
IUPAC Name: | (1S,2S)-2-phenylcyclopropane-1-carbohydrazide |
Description: | trans-2-Phenylcyclopropanecarboxylic Hydrazide can be used as reactant/reagent in preparation of phenylcyclopropyl-indolecarboxylate as umifenovir analog and its cytotoxicity and antiviral activity. |
Molecular Weight: | 176.22 |
Molecular Formula: | C10H12N2O |
Canonical SMILES: | C1C(C1C(=O)NN)C2=CC=CC=C2 |
InChI: | InChI=1S/C10H12N2O/c11-12-10(13)9-6-8(9)7-4-2-1-3-5-7/h1-5,8-9H,6,11H2,(H,12,13)/t8-,9+/m1/s1 |
InChI Key: | LVPLGMIOSVEITG-BDAKNGLRSA-N |
References: | Balzarini, J., et al. Chem Heterocyc Compd, 50, 489 (2014). |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P203, P264, P270, P273, P280, P281, P301+P317, P318, P330, P405, and P501 |
Signal Word: | Warning |
Complexity: | 199 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 2 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 176.094963011 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 176.094963011 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 55.1Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.6 |
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