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1',3'-Dihydro-8-methoxy-1',3',3'-trimethyl-6-nitrospiro[2H-1-benzopyran-2,2'-[2H]indole] - 98%, high purity , CAS No.1498-89-1

1 Citations

COA

Grade & Purity:

≥98%

Cas Number: 1498-89-1
Molecular Weight: 352.39
MDL number: MFCD00216608
PubChem CID: 99765
PubChem SID: 488187196

In stock

Item Number

D404294

Grouped product items
SKU	Size	Availability	Price
D404294-250mg	250mg	3	$30.90
D404294-1g	1g	3	$101.90
D404294-5g	5g	2	$456.90

View related series

photochromic dye (7)

Basic Description

Synonyms	1',3'-Dihydro-8-methoxy-1',3',3'-trimethyl-6-nitrospiro[2H-1- \| 8'-methoxy-6'-nitro-1,3,3-trimethylspiro(indoline-2,2'-[2h]chromene) \| AKOS015898279 \| D95411 \| Tecarfarin [USAN] \| C24H25FN4O5 \| DTXSID501124250 \| Spiro[2H-1-benzopyran-2, 8-methoxy-1',3',3'
Specifications & Purity	≥98%
Storage Temp	Argon charged
Product Description	Maximum Absorption Wavelength:269(MeOH)nm

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organoheterocyclic compounds
  - Class Benzopyrans
    - Subclass 1-benzopyrans

Kingdom	Organic compounds
Superclass	Organoheterocyclic compounds
Class	Benzopyrans
Subclass	1-benzopyrans
Intermediate Tree Nodes	Not available
Direct Parent	1-benzopyrans
Alternative Parents	Methoxyanilines Indoles and derivatives Nitroaromatic compounds Dialkylarylamines Anisoles Alkyl aryl ethers Propargyl-type 1,3-dipolar organic compounds Oxacyclic compounds Organic oxoazanium compounds Azacyclic compounds Organopnictogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework	Aromatic heteropolycyclic compounds
Substituents	1-benzopyran - Indole or derivatives - Methoxyaniline - Nitroaromatic compound - Anisole - Dialkylarylamine - Alkyl aryl ether - Benzenoid - C-nitro compound - Organic nitro compound - Ether - Organic oxoazanium - Oxacycle - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Azacycle - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic nitrogen compound - Organopnictogen compound - Organic oxide - Organic oxygen compound - Aromatic heteropolycyclic compound
Description	This compound belongs to the class of organic compounds known as 1-benzopyrans. These are organic aromatic compounds that 1-benzopyran, a bicyclic compound made up of a benzene ring fused to a pyran, so that the oxygen atom is at the 1-position.
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	488187196
Pubchem Sid Url	https://pubchem.ncbi.nlm.nih.gov/substance/488187196
IUPAC Name	8-methoxy-1',3',3'-trimethyl-6-nitrospiro[chromene-2,2'-indole]
INCHI	InChI=1S/C20H20N2O4/c1-19(2)15-7-5-6-8-16(15)21(3)20(19)10-9-13-11-14(22(23)24)12-17(25-4)18(13)26-20/h5-12H,1-4H3
InChIKey	IZDVWQPIYXTGIF-UHFFFAOYSA-N
Smiles	CC1(C2=CC=CC=C2N(C13C=CC4=C(O3)C(=CC(=C4)[N+](=O)[O-])OC)C)C
Isomeric SMILES	CC1(C2=CC=CC=C2N(C13C=CC4=C(O3)C(=CC(=C4)[N+](=O)[O-])OC)C)C
Molecular Weight	352.39
Reaxy-Rn	51344
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=51344&ln=

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

C of A & Other Certificates(BSE/TSE, COO):

Analytical Chart:

Find and download the COA for your product by matching the lot number on the packaging.

6 results found

Lot Number	Certificate Type	Date	Item
F2315030	Certificate of Analysis	Jun 02, 2023	D404294
F2315019	Certificate of Analysis	Jun 02, 2023	D404294
F2315031	Certificate of Analysis	Jun 02, 2023	D404294
F2315026	Certificate of Analysis	Jun 02, 2023	D404294
F2315033	Certificate of Analysis	Jun 02, 2023	D404294
F2315034	Certificate of Analysis	Jun 02, 2023	D404294

Chemical and Physical Properties

Sensitivity	Moisture Sensitive
Melt Point(°C)	165 °C(dec.)
Molecular Weight	352.400 g/mol
XLogP3	4.700
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	1
Exact Mass	352.142 Da
Monoisotopic Mass	352.142 Da
Topological Polar Surface Area	67.500 Å²
Heavy Atom Count	26
Formal Charge	0
Complexity	601.000
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

Citations of This Product

How to Cite Aladdin Scientific Products?

1. Linping Tian, Wenjie Zhu, Xinjie Chen, Yingxuan Feng, Hongfei Hu, Hanwei Wang, Baokang Dang, Hao Chai, Qingfeng Sun, Yushan Yang, Yingying Li. (2024) Flexible transparent wood with reversible photoresponsive property. POLYMER, 294 (126725).

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