4-Nitrobenzylamine hydrochloride - CAS 18600-42-5
Catalog: |
BB014267 |
Product Name: |
4-Nitrobenzylamine hydrochloride |
CAS: |
18600-42-5 |
Synonyms: |
(4-nitrophenyl)methanamine;hydrochloride |
IUPAC Name: | (4-nitrophenyl)methanamine;hydrochloride |
Description: | 4-Nitrobenzylamine hydrochloride (CAS# 18600-42-5) is a useful research chemical. |
Molecular Weight: | 188.61 |
Molecular Formula: | C7H9ClN2O2 |
Canonical SMILES: | C1=CC(=CC=C1CN)[N+](=O)[O-].Cl |
InChI: | InChI=1S/C7H8N2O2.ClH/c8-5-6-1-3-7(4-2-6)9(10)11;/h1-4H,5,8H2;1H |
InChI Key: | SMIXZZMSWYOQPW-UHFFFAOYSA-N |
Boiling Point: | 297.5 °C at 760 mmHg |
Melting Point: | 265 °C (dec.) |
Purity: | 95 % |
Appearance: | Light brown crystalline solid |
MDL: | MFCD00012863 |
LogP: | 3.07900 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
WO-2021126804-A1 | Indazole derivatives and methods of use thereof for the treatment of herpes viruses | 20191218 |
WO-2021116446-A1 | Functionalized heterocyclic compounds as modulators of stimulator of interferon genes (sting) | 20191211 |
US-2020131431-A1 | Chemical additives and surfactant combinations for favorable wettability alteration and improved hydrocarbon recovery factors | 20181026 |
WO-2020043831-A1 | Compounds for the modulation of cyclophilins function | 20180829 |
WO-2020035049-A1 | Degradation agents for cyclin dependent kinase, preparation method therefor, pharmaceutical composition thereof and use thereof | 20180817 |
Complexity: | 136 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 2 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 188.0352552 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 188.0352552 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 71.8 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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