Ethyl 4-hydrazinyl-3-nitrobenzoate - CAS 355425-79-5
Catalog: |
BB065686 |
Product Name: |
Ethyl 4-hydrazinyl-3-nitrobenzoate |
CAS: |
355425-79-5 |
Synonyms: |
ethyl 4-hydrazinyl-3-nitrobenzoate; ethyl4-hydrazinyl-3-nitrobenzoate |
IUPAC Name: | ethyl 4-hydrazinyl-3-nitrobenzoate |
Description: | Ethyl 4-hydrazinyl-3-nitrobenzoate |
Molecular Weight: | 225.2 |
Molecular Formula: | C9H11N3O4 |
Canonical SMILES: | CCOC(=O)C1=CC(=C(C=C1)NN)[N+](=O)[O-] |
InChI: | InChI=1S/C9H11N3O4/c1-2-16-9(13)6-3-4-7(11-10)8(5-6)12(14)15/h3-5,11H,2,10H2,1H3 |
InChI Key: | MAQFPKZXKHGKQY-UHFFFAOYSA-N |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P270, P271, P280, P301+P317, P302+P352, P304+P340, P317, P321, P330, P362+P364, and P501 |
Signal Word: | Warning |
Complexity: | 266 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 225.07495584 |
Formal Charge: | 0 |
Heavy Atom Count: | 16 |
Hydrogen Bond Acceptor Count: | 6 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 225.07495584 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 110Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.9 |
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