4-Iodo-3-nitroaniline - CAS 105752-04-3
Catalog: |
BB001703 |
Product Name: |
4-Iodo-3-nitroaniline |
CAS: |
105752-04-3 |
Synonyms: |
4-iodo-3-nitroaniline |
IUPAC Name: | 4-iodo-3-nitroaniline |
Description: | 4-Iodo-3-nitroaniline (CAS# 105752-04-3 ) is a useful research chemical. |
Molecular Weight: | 264.02 |
Molecular Formula: | C6H5IN2O2 |
Canonical SMILES: | C1=CC(=C(C=C1N)[N+](=O)[O-])I |
InChI: | InChI=1S/C6H5IN2O2/c7-5-2-1-4(8)3-6(5)9(10)11/h1-3H,8H2 |
InChI Key: | RIKZQOSCKSWUPH-UHFFFAOYSA-N |
Boiling Point: | 371.1 °C at 760 mmHg |
Melting Point: | 140-144 °C |
Purity: | 95 % |
Density: | 2.101 g/cm3 |
Appearance: | Solid |
Storage: | Keep in dark place, Sealed in dry, 2-8 °C |
MDL: | MFCD08458843 |
LogP: | 2.88600 |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P270, P272, P280, P301+P312, P302+P352, P321, P330, P333+P313, P363, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
CA-3037971-A1 | New benzimidazoles derivatives as tec kinases family inhibitors | 20150925 |
EP-3353170-A1 | New benzimidazoles derivatives as tec kinases family inhibitors | 20150925 |
US-10562893-B2 | Benzimidazoles derivatives as Tec kinases family inhibitors | 20150925 |
US-2018319781-A1 | New benzimidazoles derivatives as tec kinases family inhibitors | 20150925 |
WO-2017049401-A1 | New benzimidazoles derivatives as tec kinases family inhibitors | 20150925 |
PMID | Publication Date | Title | Journal |
15131382 | 20040501 | Hydrogen bonding in substituted nitroanilines: hydrogen-bonded sheets in 4-iodo-3-nitroaniline | Acta crystallographica. Section C, Crystal structure communications |
Complexity: | 159 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 263.93957 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 263.93957 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 71.8 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.7 |
Online Inquiry
Customer Support
Customer Centered
Related Functional Groups
Nitrogen Compounds
Customers Also Viewed
INDUSTRY LEADERS TRUST OUR PRODUCTS