ChemicalBook--->CAS DataBase List--->70516-41-5

70516-41-5

70516-41-5 Structure

70516-41-5 Structure
IdentificationBack Directory
[Name]

2'-anilino-6'-[ethyl(3-methylbutyl)amino]-3'-methylspiro[isobenzofuran-1(3H),9'-[9H]xanthene]-3-one
[CAS]

70516-41-5
[Synonyms]

S-205
WinCon-205
S 205 (dye)
S 205 Black
Yamada S 205
R-401(S-205)
3-N-Isoamyl-N-ethylamino-6-methyl-7-anilinofluoran
2-Anilino-6-(N-ethyl-N-isoamylamino)-3-methylfluoran
3-(N-Ethyl-N-Isopentylamino)-6-Methyl-7-Anilinofluoran
3-(N-Ethyl-N-isoaMylaMino)-6-Methyl-7-phenylaMinofluoran
6'-(N-Isoamyl-N-ethylamino)-3'-methyl-2'-phenylaminofluoran
WinCon-205 (3-(N-ethyl-N-isopentylaMino)-6-Methyl-7-anilinofluoran
2'-Anilino-6'-(N-ethylisopentylamino)-3'-methylspiro[phthalide-3,9'-[9H]xanthene]
2'-Anilino-6'-(N-ethyl-N-isopentylamino)-3'-methylspiro[phthalide-3,9'-[9H]xanthene]
2'-anilino-6'-[ethyl(3-methylbutyl)amino]-3'-methyl-1-spiro[isobenzofuran-3,9'-xanthene]one
6'-(Ethyl(isopentyl)amino)-3'-methyl-2'-(phenylamino)-3H-spiro[isobenzofuran-1,9'-xanthen]-3-one
6'-(ETHYL-(3-METHYLBUTYL)AMINO)-3'-METHYL-2'-(PHENYLAMINO)SPIRO[2-BENZOFURAN-3,9'-XANTHENE]-1-ONE
2'-anilino-6'-[ethyl(3-methylbutyl)amino]-3'-methylspiro[isobenzofuran-1(3H),9'-[9H]xanthene]-3-one
6'-[ethyl(3-methylbutyl)amino]-3'-methyl-2'-(phenylamino)-Spiro[isobenzofuran-1(3H),9'-[9H]xanthen]-3-one
Spiro[isobenzofuran-1(3H),9'-[ 9H]xanthen]-3-one, 6'-[ethyl(3-methylbutyl)amino]-3'-m ethyl-2'-(phenylamino)-
[EINECS(EC#)]

274-641-1
[Molecular Formula]

C34H34N2O3
[MDL Number]

MFCD11044531
[MOL File]

70516-41-5.mol
[Molecular Weight]

518.65
Chemical PropertiesBack Directory
[Melting point ]

166-168℃
[Boiling point ]

692.2±55.0 °C(Predicted)
[density ]

1.25±0.1 g/cm3(Predicted)
[vapor pressure ]

0Pa at 25℃
[storage temp. ]

Keep in dark place,Inert atmosphere,2-8°C
[pka]

5.24±0.20(Predicted)
[Appearance]

White to off-white Solid
[Water Solubility ]

100μg/L
[Henry's Law Constant]

8.4×107 mol/(m3Pa) at 25℃, Zhang et al. (2010)
[InChIKey]

HUSIBQLZEMMTCQ-UHFFFAOYSA-N
[SMILES]

C12(C3=C(C=C(N(CC)CCC(C)C)C=C3)OC3=C1C=C(NC1=CC=CC=C1)C(C)=C3)C1=C(C=CC=C1)C(=O)O2
[LogP]

4.2 at 20℃
[EPA Substance Registry System]

Spiro[isobenzofuran-1(3H),9'-[9H]xanthen]-3-one, 6'-[ethyl(3-methylbutyl)amino]-3'-methyl-2'-(phenylamino)- (70516-41-5)
Safety DataBack Directory
[TSCA ]

TSCA listed
[REACH Registrations]

Active
Hazard InformationBack Directory
[Chemical Properties]

6'-(Ethyl-(3-methylbutyl)amino)-3'-methyl-2'-(phenylamino)spiro[2-benzofuran-3,9'-xanthene]-1-one is an excellent coupler. The fluoran compound has two different crystal forms, one High melting point crystal, its melting point is in the range of 164-168℃; a low melting point crystal, its melting point is in the range of 145-156℃. Among these two different crystal forms, as a coupler in thermal or pressure-sensitive recording materials, the high-melting-point crystalline compound has the advantages of fast color development and not easy to fade.

1.1.jpg

[Application]

6'-(Ethyl-(3-methylbutyl)amino)-3'-methyl-2'-(phenylamino)spiro[2-benzofuran-3,9'-xanthene]-1-one is a kind of black fluoran thermopressure-sensitive dye, which is based on xanthene type. compound of the parent structure. It is usually a colorless or light-colored crystal, and when it comes into contact with a color developer (acid clay, bisphenol A, POB, etc.), it develops color with the cracking of the lactone ring in the molecule.
[Flammability and Explosibility]

Nonflammable
[Synthesis]

6'-(Ethyl-(3-methylbutyl)amino)-3'-methyl-2'-(phenylamino)spiro[2-benzofuran-3,9'-xanthene]-1-one can be prepared from 2-[4-(N-ethyl-N-isopentyl)amino-2-hydroxy-benzoyl]sodium benzoate and 4-methoxy-2-methyldiphenylamine in concentrated sulfuric acid, hydrogen Reaction under the action of sodium.
[References]

[1] Patent: CN105838105, 2016, A. Location in patent: Paragraph 0083; 0084; 0085; 0086
Spectrum DetailBack Directory
[Spectrum Detail]

2'-anilino-6'-[ethyl(3-methylbutyl)amino]-3'-methylspiro[isobenzofuran-1(3H),9'-[9H]xanthene]-3-one(70516-41-5)1HNMR
70516-41-5 suppliers list
Company Name: Shanghai Tejin Supply Chain Management Co., Ltd  Gold
Telephone: 18918514262; 18918514262
Website: https://www.chemicalbook.com/supplier/148407120/
Company Name: Wuhan Haishan Technology Co. Ltd.  Gold
Telephone: 027-86637880 17720597715
Website: http://www.haishankj.net
Company Name: XiaoGan ShenYuan ChemPharm co,ltd  
Telephone: 15527621225; 15527621225
Website: http://www.farchem.com/
Company Name: Beijing Isomersyn Technology CO;LTD  
Telephone: 010-82954736 13391601435
Website: www.chemicalbook.com/supplier/10680452/1.htm
Company Name: Hunan Hui Bai Shi Biotechnology Co., Ltd.  
Telephone: 0731-85526065 13308475853
Website: http://www.hnhbsj.com/
Company Name: Nanjing Norris-Pharm Technology Co., Ltd  
Telephone: 13901585132
Website:
Company Name: Jiangsu Aikon Biopharmaceutical R&D co.,Ltd.  
Telephone: 025-66113011 13913916777
Website: www.aikonchem.com/
Company Name: Bide Pharmatech Ltd.  
Telephone: 400-164-7117 18317119277
Website: www.bidepharm.com
Company Name: ShangHai D&B Biological Science and Technology Co.Ltd  
Telephone: 400-008-9730,021-54359730 400-008-9730
Website: http://www.chemxyz.cn
Company Name: Shanghai Yongye Biotechnology Co., Ltd.  
Telephone: 86-021-61559134 15921386130
Website: www.shyongye.com
Company Name: Hubei kangen Pharmaceutical Chemical Co., Ltd  
Telephone: 180-64105258 18064105258
Website: www.chemicalbook.com/supplier/10564672/
Company Name: Shanghai YuanYe Biotechnology Co., Ltd.  
Telephone: 15026964105
Website: www.shyuanye.com
Company Name: Amadis Chemical Company Limited  
Telephone: 571-89925085
Website: http://www.amadischem.com
Company Name: Guangzhou Jhd Chemical Reagent Co., Ltd.  
Telephone: 020-84383047
Website: www.jhd.com.cn
Company Name: Shanghai Time Chemicals CO., Ltd.  
Telephone: 021-57951555
Website: www.time-chemicals.com
Company Name: Jiangxi Lotchem Co., Ltd.  
Telephone: 0791-0791-85061535 15270827708
Website: www.jxlotchem.com
Company Name: Shanghai Jizhi Biochemical Technology Co. Ltd.  
Telephone: 021-4009004166/18616739031 18616739031
Website: http://www.acmec-e.com/
Company Name: CD Chemical Group Limited  
Telephone: +86-13651442114
Website: http://www.codchem.com/
Tags:70516-41-5 Related Product Information
87-41-2 41317-15-1 29512-49-0