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4'- (4-Nitrobenzyloxy) acetophenone

CAT: 0024-sc-267831Size: 1 gDry Ice: NoHazardous: No
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CAT#:0024-sc-267831Size:1 g
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CAS Number
205748-03-4

Chemical Information

4'-(4-Nitrobenzyloxy)acetophenone
CAS Number205748-03-4
PubChem CID2801340
IUPAC Name1-[4-[(4-nitrophenyl)methoxy]phenyl]ethanone
Molecular FormulaC15H13NO4
Molecular Weight271.27
XLogP2.9
Topological Polar Surface Area72.1
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count4
Heavy Atom Count20
Formal Charge0
Complexity336
SMILES
CC(=O)C1=CC=C(C=C1)OCC2=CC=C(C=C2)[N+](=O)[O-]
InChI
InChI=1S/C15H13NO4/c1-11(17)13-4-8-15(9-5-13)20-10-12-2-6-14(7-3-12)16(18)19/h2-9H,10H2,1H3
InChIKey
GUBOWULDVFKCRF-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 4'-(4-Nitrobenzyloxy)acetophenone
CAS: 205748-03-4
CID: 2801340
Formula: C15H13NO4
MW: 271.27
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight271.27
XLogP32.9
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count4
Exact Mass271.08445790
Monoisotopic Mass271.08445790
Topological Polar Surface Area72.1 Ų
Heavy Atom Count20
Formal Charge0
Complexity336
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Related Products

CatalogName
sc-2613564- (4-Nitrobenzyloxy) benzaldehyde
sc-2610343-Methoxy-4- (4-nitrobenzyloxy) benzaldehyde
sc-3232904'- (4-Chlorophenoxy) acetophenone
sc-3232894'- (4-Bromobenzyloxy) acetophenone
sc-2330914'- (4-Bromophenyl) acetophenone
sc-336587A4'- (4-Phenylphenoxy) acetophenone
sc-2622344'- (4-Fluorobenzyloxy) acetophenone
sc-323291A4'- (Ethylthio) acetophenone
sc-2622364'- (Ethylsulphonyl) acetophenone
sc-2330934'- (Trifluoromethoxy) acetophenone

Alternative Products

CatalogName
BRA89283-014'- (Pentafluorosulfur) acetophenone
TRC-M329080-1G4-(Methylsulfonyl)acetophenone
PC7433E-014'- (Trifluoromethoxy) acetophenone
PC8042-014'- (Trifluoromethylthio) acetophenone
PC6195-014'- (Trifluoroacetyl) acetophenone
OR1654-014'- (Benzyloxy) acetophenone
FA72057-014-Acetophenone oxime
abx183479-014-(Trifluoromethyl)acetophenone
OR8170-014'- (Ethylsulphonyl) acetophenone
OR15434'- (Methylsulphonyl) acetophenone

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