3-Diazooxindole

CAT: 0127-OR87118-01Size: 100 mgDry Ice: NoHazardous: No

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CAT#:0127-OR87118-01Size:100 mg

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CAS Number

3265-29-0

MDL Number

MFCD00224148

Purity

95%

Smiles

O=C1NC2=C(C=CC=C2)C1=[N+]=[N-]

Chemical Information

3-Diazooxindole

CAS Number	3265-29-0
PubChem CID	555022
IUPAC Name	3-diazonio-1H-indol-2-olate
Molecular Formula	C8H5N3O
Molecular Weight	159.14
XLogP	3.3
Topological Polar Surface Area	67
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	0
Heavy Atom Count	12
Formal Charge	0
Complexity	222

SMILES

C1=CC=C2C(=C1)C(=C(N2)[O-])[N+]#N

InChI

InChI=1S/C8H5N3O/c9-11-7-5-3-1-2-4-6(5)10-8(7)12/h1-4,9H

InChIKey

JUWOBCNAWKDBSM-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 3265-29-0

CID: 555022

Formula: C8H5N3O

MW: 159.14

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	159.14
XLogP3	3.3
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	0
Exact Mass	159.043261791
Monoisotopic Mass	159.043261791
Topological Polar Surface Area	67 Å²
Heavy Atom Count	12
Formal Charge	0
Complexity	222
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
PC6825	3,3,3-Trifluoropropyl 3,3,3-trifluoropropanoate
PC7820FJ-01	3- (3,3,3-Trifluoropropyl) heptamethyltrisiloxane
PC1007482-01	3,3,3-Trifluoropropanehydrazide
PC4452-01	3,3,3-Trifluoropropylmethyldimethoxysilane
PC4603-01	3,3,3-Trifluoropropylamine
OR1043029-01	3,3',3''-Nitrilotripropanamide
OR89892-01	3,3',3''-Nitrilotripropanenitrile
PC901625	3,3,3-Trifluoropropanamide
PC450524-01	3,3,3-Trifluoropropoxytriethylsilane
OR1060769-01	3,3',3''-Phosphanetriyltriphenol

Catalog	Name
TRC-D492170-50MG	4-[2-(Dipropylamino)ethyl]-3-diazooxindole
161150	4-[2- (Dipropylamino) ethyl]-3-diazooxindole
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
sc-347307A	3,3,3-trifluoropropanamide