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6'-(Indolin-1-yl)-1,3,3-trimethylspiro[indoline-2,3'-naphtho[2,1-b][1,4]oxazine] - 95%, high purity , CAS No.114747-44-3

COA

Grade & Purity:

≥95%

Cas Number: 114747-44-3
Molecular Weight: 445.56
MDL number: MFCD00329019
PubChem CID: 3104873
PubChem SID: 488194305

In stock

Item Number

I302242

Grouped product items
SKU	Size	Availability	Price
I302242-250mg	250mg	3	$9.90
I302242-1g	1g	10	$26.90
I302242-5g	5g	9	$91.90
I302242-25g	25g	1	$357.90

Discover 6'-(Indolin-1-yl)-1,3,3-trimethylspiro[indoline-2,3'-naphtho[2,1-b][1,4]oxazine] by Aladdin Scientific in 95% for only $9.90. Available - in Ligands at Aladdin Scientific. Tags: .

Basic Description

Synonyms	114747-44-3 \| 6'-(Indolin-1-yl)-1,3,3-trimethylspiro[indoline-2,3'-naphtho[2,1-b][1,4]oxazine] \| MFCD00329019 \| 6-(2,3-dihydroindol-1-yl)-1',3',3'-trimethylspiro[benzo[f][1,4]benzoxazine-3,2'-indole] \| Spiro[2H-indole-2,3'-[3H]naphth[2,1-b][1,4]oxazine], 6'-(2,3-
Specifications & Purity	≥95%
Storage Temp	Protected from light,Room temperature,Desiccated
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organic nitrogen compounds
  - Class Organonitrogen compounds
    - Subclass Amines
      - Level5 Tertiary amines
        Level6 Tertiary alkylarylamines
        Level7 Alkyldiarylamines

Kingdom	Organic compounds
Superclass	Organic nitrogen compounds
Class	Organonitrogen compounds
Subclass	Amines
Intermediate Tree Nodes	Tertiary amines - Tertiary alkylarylamines
Direct Parent	Alkyldiarylamines
Alternative Parents	Naphthalenes Benzoxazines Indoles and derivatives Dialkylarylamines Aralkylamines Propargyl-type 1,3-dipolar organic compounds Oxacyclic compounds Azacyclic compounds Organooxygen compounds Imines Hydrocarbon derivatives
Molecular Framework	Aromatic heteropolycyclic compounds
Substituents	Alkyldiarylamine - Benzoxazine - Naphthalene - Indole or derivatives - Dialkylarylamine - Aralkylamine - Benzenoid - Azacycle - Organoheterocyclic compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Oxacycle - Organic oxygen compound - Organooxygen compound - Imine - Hydrocarbon derivative - Aromatic heteropolycyclic compound
Description	This compound belongs to the class of organic compounds known as alkyldiarylamines. These are tertiary alkylarylamines having two aryl and one alkyl groups attached to the amino group.
External Descriptors	Not available
1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61. DOI: 10.1186/s13321-016-0174-y

Names and Identifiers

Pubchem Sid	488194305
IUPAC Name	6-(2,3-dihydroindol-1-yl)-1',3',3'-trimethylspiro[benzo[f][1,4]benzoxazine-3,2'-indole]
INCHI	InChI=1S/C30H27N3O/c1-29(2)23-13-7-9-15-25(23)32(3)30(29)19-31-28-22-12-6-5-11-21(22)26(18-27(28)34-30)33-17-16-20-10-4-8-14-24(20)33/h4-15,18-19H,16-17H2,1-3H3
InChIKey	PITZBBWQUBGWTD-UHFFFAOYSA-N
Smiles	CC1(C2=CC=CC=C2N(C13C=NC4=C(O3)C=C(C5=CC=CC=C54)N6CCC7=CC=CC=C76)C)C
Isomeric SMILES	CC1(C2=CC=CC=C2N(C13C=NC4=C(O3)C=C(C5=CC=CC=C54)N6CCC7=CC=CC=C76)C)C
Molecular Weight	445.56
Reaxy-Rn	5364134
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=5364134&ln=

Certificates（CoA,COO,BSE/TSE and Analysis Chart)

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Analytical Chart:

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6 results found

Lot Number	Certificate Type	Date	Item
D2315775	Certificate of Analysis	Aug 29, 2022	I302242
J2226521	Certificate of Analysis	Aug 29, 2022	I302242
J2226531	Certificate of Analysis	Aug 29, 2022	I302242
J2226547	Certificate of Analysis	Aug 29, 2022	I302242
D2315748	Certificate of Analysis	Aug 29, 2022	I302242
J2226553	Certificate of Analysis	Aug 29, 2022	I302242

Chemical and Physical Properties

Sensitivity	Light sensitive
Flash Point(°C)	368.4°C
Boil Point(°C)	685.5°C at 760 mmHg
Molecular Weight	445.600 g/mol
XLogP3	6.800
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	1
Exact Mass	445.215 Da
Monoisotopic Mass	445.215 Da
Topological Polar Surface Area	28.100 Å²
Heavy Atom Count	34
Formal Charge	0
Complexity	811.000
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
The total count of all stereochemical bonds	0
Covalently-Bonded Unit Count	1

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