3-Nitrobenzophenone - CAS 2243-80-3
Catalog: |
BB017618 |
Product Name: |
3-Nitrobenzophenone |
CAS: |
2243-80-3 |
Synonyms: |
(3-nitrophenyl)-phenylmethanone |
IUPAC Name: | (3-nitrophenyl)-phenylmethanone |
Description: | 3-Nitrobenzophenone (CAS# 2243-80-3) is a useful research chemical. |
Molecular Weight: | 227.22 |
Molecular Formula: | C13H9NO3 |
Canonical SMILES: | C1=CC=C(C=C1)C(=O)C2=CC(=CC=C2)[N+](=O)[O-] |
InChI: | InChI=1S/C13H9NO3/c15-13(10-5-2-1-3-6-10)11-7-4-8-12(9-11)14(16)17/h1-9H |
InChI Key: | MFYLRNKOXORIPK-UHFFFAOYSA-N |
Boiling Point: | 377.9 °C at 760 mmHg |
Density: | 1.266 g/cm3 |
Appearance: | Tan to light brown crystalline powder |
MDL: | MFCD00007257 |
LogP: | 3.34900 |
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-2021000218-A1 | Aqueous dispersion and aqueous coating composition comprising the same | 20190701 |
EP-3717464-B1 | Nitration | 20181026 |
WO-2019190624-A1 | Asphalt composition and method of using same in tack coats | 20180327 |
EP-3775049-A1 | Asphalt composition and method of using same in tack coats | 20180327 |
US-2021017388-A1 | Asphalt composition and method of using same in tack coats | 20180327 |
Complexity: | 292 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 227.058243149 |
Formal Charge: | 0 |
Heavy Atom Count: | 17 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 227.058243149 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 62.9 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.1 |
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