3,3′-Biphthalide

CAT: 1299-RG-A262872-02Size: 25 mgDry Ice: NoHazardous: No

1 / 1

CAT#:1299-RG-A262872-02Size:25 mg

Selected

24/48H Stock Items & 2 to 6 Weeks non Stock Items.

Quick Request Actions

CAS Number

4281-21-4

Synonyms

[1,1'-biisobenzofuran]-3,3' (1H,1'H) -dione

Molecular Formula

C16H10O4

Molecular Weight

266.25

Product Name Synonym

[1,1'-biisobenzofuran]-3,3' (1H,1'H) -dione

Chemical Information

ST041028

CAS Number	4281-21-4
PubChem CID	2750212
IUPAC Name	3-(3-oxo-1H-2-benzofuran-1-yl)-3H-2-benzofuran-1-one
Molecular Formula	C16H10O4
Molecular Weight	266.25
XLogP	2.5
Topological Polar Surface Area	52.6
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	1
Heavy Atom Count	20
Formal Charge	0
Complexity	392

SMILES

C1=CC=C2C(=C1)C(OC2=O)C3C4=CC=CC=C4C(=O)O3

InChI

InChI=1S/C16H10O4/c17-15-11-7-3-1-5-9(11)13(19-15)14-10-6-2-4-8-12(10)16(18)20-14/h1-8,13-14H

InChIKey

MEGDIXZGVAJMRG-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 4281-21-4

CID: 2750212

Formula: C16H10O4

MW: 266.25

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	266.25
XLogP3	2.5
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	1
Exact Mass	266.05790880
Monoisotopic Mass	266.05790880
Topological Polar Surface Area	52.6 Å²
Heavy Atom Count	20
Formal Charge	0
Complexity	392
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	2
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
RG-F122148-01	3- (3-Fluorophenyl) -3-Oxopropanenitrile
RG-E140739-01	3,3'-Diaminodipropylamine
RG-E140863-01	3,3'-bipyridine
RG-E141213-01	3,3'-Diindolylmethane
RG-P022549-01	3,3'-Oxydiphenol
RG-D090525-01	3,3-Diethoxypropanenitrile
RG-E141560-01	3-amino-3,3-dicyanopropanoic acid
RG-P081503-01	3,3',3''-Phosphinetriyltripropanoic Acid Hydrochloride
RG-E141562-01	3-amino-3,3-dicyano-2-oxopropanamide
RG-E141561-01	3,3-dicyano-2,3-dihydroxypropanoic acid

Catalog	Name
PC6825	3,3,3-Trifluoropropyl 3,3,3-trifluoropropanoate
QMC01729-01	3- (3,3,3-Trifluoropropoxy) pyridine
JFC42829-01	3- (3,3,3-Trifluoropropyl) aniline
sc-260433	3- (3,3,3-Trifluoropropyl) heptamethyltrisiloxane
PDC53711-01	3- (3,3,3-Trifluoropropoxy) piperidine
NU-456L	3',3',3'-cAAG
JMB17199-01	3,3,3-Trifluoropropanehydrazide
sc-261129	3,3,3-Trifluoropropionitrile
PC4452-01	3,3,3-Trifluoropropylmethyldimethoxysilane
PC4603-01	3,3,3-Trifluoropropylamine