4-Nitrodiphenylmethane - CAS 1817-77-2
Catalog: |
BB013836 |
Product Name: |
4-Nitrodiphenylmethane |
CAS: |
1817-77-2 |
Synonyms: |
1-benzyl-4-nitrobenzene |
IUPAC Name: | 1-benzyl-4-nitrobenzene |
Description: | 4-Nitrodiphenylmethane (CAS# 1817-77-2) is a useful research chemical. |
Molecular Weight: | 213.23 |
Molecular Formula: | C13H11NO2 |
Canonical SMILES: | C1=CC=C(C=C1)CC2=CC=C(C=C2)[N+](=O)[O-] |
InChI: | InChI=1S/C13H11NO2/c15-14(16)13-8-6-12(7-9-13)10-11-4-2-1-3-5-11/h1-9H,10H2 |
InChI Key: | IDSGFSCSMXRJON-UHFFFAOYSA-N |
Boiling Point: | 351.9 °C at 760 mmHg |
Purity: | 95 % |
Density: | 1.145 g/mL at 25 °C (lit.) |
MDL: | MFCD00024783 |
LogP: | 3.70880 |
GHS Hazard Statement: | H317 (100%): May cause an allergic skin reaction [Warning Sensitization, Skin] |
Precautionary Statement: | P261, P272, P280, P302+P352, P321, P333+P313, P363, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
WO-2021201054-A1 | Non-aqueous electrolyte for battery, precursor for lithium secondary battery, method for manufacturing lithium secondary battery, lithium secondary battery, phosphazene compound, and additive for battery | 20200331 |
CN-109759109-A | The preparation and the application in nitrobenzene compounds hydrogenation reaction that nitrogen modifies charcoal supported noble metal hydrogenation catalyst | 20181128 |
CN-109843935-A | Dispersion liquid | 20161028 |
CN-106431862-A | Method for preparing diaryl ketone by means of spontaneously oxidizing diaryl alkane under promotion effect of alkali | 20160921 |
US-10017471-B2 | Selective androgen receptor degrader (SARD) ligands and methods of use thereof | 20150421 |
Complexity: | 223 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 213.078978594 |
Formal Charge: | 0 |
Heavy Atom Count: | 16 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 213.078978594 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 45.8 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 4.1 |
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