(3'-Nitropropiophenone) - CAS 17408-16-1
Catalog: |
BB012984 |
Product Name: |
(3'-Nitropropiophenone) |
CAS: |
17408-16-1 |
Synonyms: |
1-(3-nitrophenyl)propan-1-one |
IUPAC Name: | 1-(3-nitrophenyl)propan-1-one |
Description: | (3'-Nitropropiophenone) (CAS# 17408-16-1) is a useful research chemical. |
Molecular Weight: | 179.17 |
Molecular Formula: | C9H9NO3 |
Canonical SMILES: | CCC(=O)C1=CC(=CC=C1)[N+](=O)[O-] |
InChI: | InChI=1S/C9H9NO3/c1-2-9(11)7-4-3-5-8(6-7)10(12)13/h3-6H,2H2,1H3 |
InChI Key: | VSPOTMOYDHRALZ-UHFFFAOYSA-N |
Boiling Point: | 254.5 ℃ at 760 mmHg |
Density: | 1.199 g/cm3 |
MDL: | MFCD00051516 |
LogP: | 2.71070 |
Publication Number | Title | Priority Date |
CN-112724957-B | Preparation method of high-temperature-resistant composite cross-linking agent | 20210401 |
CN-109971248-A | A kind of preparation method of edible ink | 20190423 |
CN-109390156-A | One kind disappears hydrogen agent and preparation method thereof, aluminum electrolytic capacitor electrolyte | 20170804 |
CN-109390156-B | One kind disappears hydrogen agent and preparation method thereof, aluminum electrolytic capacitor electrolyte | 20170804 |
WO-2019024411-A1 | HYDROGEN REMOVAL AGENT AND PROCESS FOR PREPARING THE SAME, AND ELECTROLYTE FOR ALUMINUM ELECTROLYTIC CAPACITOR | 20170804 |
PMID | Publication Date | Title | Journal |
20031481 | 20100201 | Vibrational spectroscopy investigation using ab initio and density functional theory on 3'-chloropropiophenone and 3'-nitropropiophenone | Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy |
Complexity: | 209 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 179.058243149 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 179.058243149 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 62.9 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.9 |
Online Inquiry
Customer Support
Customer Centered
Related Functional Groups
Carbonyl Compounds
Customers Also Viewed
INDUSTRY LEADERS TRUST OUR PRODUCTS