4-Methoxy-4'-nitrobenzophenone

CAT: 0024-sc-267604Size: 1 gDry Ice: NoHazardous: No

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CAT#:0024-sc-267604Size:1 g

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CAS Number

1151-94-6

Chemical Information

4-Methoxy-4'-nitrobenzophenone

CAS Number	1151-94-6
PubChem CID	347772
IUPAC Name	(4-methoxyphenyl)-(4-nitrophenyl)methanone
Molecular Formula	C14H11NO4
Molecular Weight	257.24
XLogP	3.4
Topological Polar Surface Area	72.1
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	3
Heavy Atom Count	19
Formal Charge	0
Complexity	323

SMILES

COC1=CC=C(C=C1)C(=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C14H11NO4/c1-19-13-8-4-11(5-9-13)14(16)10-2-6-12(7-3-10)15(17)18/h2-9H,1H3

InChIKey

DXVSAELNVPXMSQ-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 1151-94-6

CID: 347772

Formula: C14H11NO4

MW: 257.24

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	257.24
XLogP3	3.4
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	3
Exact Mass	257.06880783
Monoisotopic Mass	257.06880783
Topological Polar Surface Area	72.1 Å²
Heavy Atom Count	19
Formal Charge	0
Complexity	323
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
sc-223642	4-Nitrobenzophenone
sc-223642A	4-Nitrobenzophenone
sc-261954	4-Fluoro-4'-nitrobenzophenone
sc-233032	4,4'-Dichloro-3-nitrobenzophenone
sc-277243	4-Chloro-3-nitrobenzophenone
sc-472196	4-Nitrobenzophenone oxime resin
sc-226477	4-Amino-3-nitrobenzophenone
sc-232576	4-Chloro-4'-methyl-3-nitrobenzophenone
sc-209368	2'-Carboxy-4-dimethylamino-2-hydroxy-4'-nitrobenzophenone
sc-216827	4-Dimethylamino-2-hydroxy-2'-methoxycarbonyl-4'-nitrobenzophenone

Catalog	Name
OR0578-01	4-Methoxy-4'-nitrobenzophenone
285401-01	4-Nitrobenzophenone
PC3702	2-Fluoro-4'-methoxy-3'-nitrobenzophenone
PC3938E	4-Fluoro-4'-nitrobenzophenone
OR2920-01	4-Chloro-4'-nitrobenzophenone
N07270-01	4-Nitrobenzophenone 97%
abx188454	4-Chloro-3-Nitrobenzophenone
FH70721-01	4-Hydroxy-3-nitrobenzophenone
FA37243	4-Amino-3-nitrobenzophenone
TRC-C369385-25G	4-Chloro-4'-methyl-3-nitrobenzophenone