4-Nitrobenzaldehyde oxime - CAS 1129-37-9
Catalog: |
BB003085 |
Product Name: |
4-Nitrobenzaldehyde oxime |
CAS: |
1129-37-9 |
Synonyms: |
N-[(4-nitrophenyl)methylidene]hydroxylamine |
IUPAC Name: | (NE)-N-[(4-nitrophenyl)methylidene]hydroxylamine |
Description: | 4-Nitrobenzaldehyde oxime (CAS# 1129-37-9) is a useful research chemical compound. |
Molecular Weight: | 166.13 |
Molecular Formula: | C7H6N2O3 |
Canonical SMILES: | C1=CC(=CC=C1C=NO)[N+](=O)[O-] |
InChI: | InChI=1S/C7H6N2O3/c10-8-5-6-1-3-7(4-2-6)9(11)12/h1-5,10H |
InChI Key: | WTLPAVBACRIHHC-UHFFFAOYSA-N |
Boiling Point: | 304.2 °C at 760 mmHg |
Melting Point: | 126-131 °C |
Purity: | 95 % |
Density: | 1.33 g/cm3 |
Appearance: | Light yellow crystalline powder |
Storage: | Store in a tightly closed container. Store in a cool, dry, well-ventilated area away from incompatible substances. |
MDL: | MFCD00007377 |
LogP: | 1.92610 |
GHS Hazard Statement: | H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P270, P271, P280, P301+P310, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Danger |
Publication Number | Title | Priority Date |
WO-2019067635-A1 | METHODS AND SYSTEMS FOR NUCLEIC ACID SEQUENCING | 20170927 |
US-2020318170-A1 | Methods and systems for nucleic acid sequencing | 20170927 |
WO-2017009746-A1 | An improved process for the preparation of sofosbuvir | 20150711 |
EP-2588487-A1 | A new method of using n-thio compounds for oligonucleotide synthesis | 20100630 |
EP-2588487-B1 | A new method of using n-thio compounds for oligonucleotide synthesis | 20100630 |
PMID | Publication Date | Title | Journal |
21579179 | 20100421 | (E)-4-Nitro-benzaldehyde oxime | Acta crystallographica. Section E, Structure reports online |
Complexity: | 180 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 1 |
Exact Mass: | 166.03784206 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 166.03784206 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 78.4 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2 |
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