4-Iodobenzhydrazide - CAS 39115-95-2
Catalog: |
BB023843 |
Product Name: |
4-Iodobenzhydrazide |
CAS: |
39115-95-2 |
Synonyms: |
4-iodobenzohydrazide; 4-iodobenzohydrazide |
IUPAC Name: | 4-iodobenzohydrazide |
Description: | 4-Iodobenzhydrazide (CAS# 39115-95-2) is a useful research chemical. |
Molecular Weight: | 262.05 |
Molecular Formula: | C7H7IN2O |
Canonical SMILES: | C1=CC(=CC=C1C(=O)NN)I |
InChI: | InChI=1S/C7H7IN2O/c8-6-3-1-5(2-4-6)7(11)10-9/h1-4H,9H2,(H,10,11) |
InChI Key: | ZVFGHUJYTXEOSI-UHFFFAOYSA-N |
Boiling Point: | 370.1 ℃ at 760 mmHg |
Density: | 1.884 g/cm3 |
MDL: | MFCD00270107 |
LogP: | 1.98590 |
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 |
Publication Number | Title | Priority Date |
US-2019127365-A1 | Inhibitors of hepatitis c virus replication | 20171101 |
EP-3523306-A1 | Spirocyclic compounds | 20161005 |
US-2020207776-A1 | Spirocyclic compounds | 20161005 |
WO-2018067512-A1 | Spirocyclic compounds | 20161005 |
US-10934304-B2 | Spirocyclic compounds | 20161005 |
PMID | Publication Date | Title | Journal |
21581046 | 20081025 | 4-Iodo-benzohydrazide | Acta crystallographica. Section E, Structure reports online |
14903503 | 19520401 | Chemotherapy of experimental tuberculosis. V. Isonicotinic acid hydrazide (nydrazid) and related compounds | American review of tuberculosis |
Complexity: | 143 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 261.96031 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 261.96031 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 55.1 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.6 |
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