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26857-61-4

Basic Information
CAS No.: 26857-61-4
Name: TIN(IV) 2,3-NAPHTHALOCYANINE DICHLORIDE
Article Data: 1
Molecular Structure:
Molecular Structure of 26857-61-4 (TIN(IV) 2,3-NAPHTHALOCYANINE DICHLORIDE)
Formula: C48H24Cl2N8Sn
Molecular Weight: 902.388
Synonyms: Tin,dichloro[37H,39H-tetranaphtho[2,3-b:2',3'-g:2'',3''-l:2''',3'''-q]porphyrazinato(2-)-N37,N38,N39,N40]-,(OC-6-12)-;Tin,dichloro[tetranaphtho[2,3-b:2',3'-g:2'',3''-l:2''',3'''-q]porphyrazinato(2-)]-(8CI);37H,39H-Tetranaphtho[2,3-b:2',3'-g:2'',3''-l:2''',3'''-q]porphyrazine,tin complex;37H,39H-Tetranaphtho[2,3-b:2',3'-g:2'',3''-l:2''',3'''-q]porphyrazine, tinderiv.;
Melting Point: >300 °C(lit.)
Hazard Symbols: IrritantXi
Risk Codes: 36/37/38
Safety: 26-36
PSA: 84.02000
LogP: 7.07540
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  • 26857-61-4  CAS NO.26857-61-4

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Specification

The Tin(IV) 2,3-naphthalocyanine dichloride, with CAS registry number 26857-61-4, belongs to the following product categories: (1)Stains and Dyes; (2)Stains&Dyes, A to; (3)T-U-V. And the chemical formula of this chemical is C48H24Cl2N8Sn. Its molecular weight is 902.37.

Physical properties of Tin(IV) 2,3-naphthalocyanine dichloride: (1)#H bond acceptors: 8; (2)#H bond donors: 0; (3)#Freely Rotating Bonds: 0; (4)Polar Surface Area: 82.33 Å2.

When you are using this chemical, please be cautious about it as the following:
The Tin(IV) 2,3-naphthalocyanine dichloride irritates to eyes, respiratory system and skin. When use it, wear suitable protective clothing, gloves and eye/face protection. If contact with eyes, rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure:
(1)SMILES: c1cc2c(cc3c/4n5c(c3c2)/nc/6\nc(/nc/7\n(/c(n\c-8n/c(n4)/c9c8cc2c(c9)cccc2)/c2c7cc3c(c2)cccc3)[Sn]5(Cl)Cl)-c2c6cc3c(c2)cccc3)cc1
(2)InChI: InChI=1/C48H24N8.2ClH.Sn/c1-2-10-26-18-34-33(17-25(26)9-1)41-49-42(34)54-44-37-21-29-13-5-6-14-30(29)22-38(37)46(51-44)56-48-40-24-32-16-8-7-15-31(32)23-39(40)47(52-48)55-45-36-20-28-12-4-3-11-27(28)19-35(36)43(50-45)53-41;;;/h1-24H;2*1H;/q-2;;;+4/p-2/rC48H24Cl2N8Sn/c49-59(50)57-45-37-21-29-13-5-6-14-30(29)22-38(37)47(57)55-43-35-19-27-11-3-4-12-28(27)20-36(35)44(52-43)56-48-40-24-32-16-8-7-15-31(32)23-39(40)46(58(48)59)54-42-34-18-26-10-2-1-9-25(26)17-33(34)41(51-42)53-45/h1-24H/b53-41-,53-45u,54-42u,54-46u,55-43u,55-47u,56-44u,56-48u
(3)InChIKey: DQQMDUNOVOLBEK-ADNJZPOABB
(4)Std. InChI: InChI=1S/C48H24N8.2ClH.Sn/c1-2-10-26-18-34-33(17-25(26)9-1)41-49-42(34)54-44-37-21-29-13-5-6-14-30(29)22-38(37)46(51-44)56-48-40-24-32-16-8-7-15-31(32)23-39(40)47(52-48)55-45-36-20-28-12-4-3-11-27(28)19-35(36)43(50-45)53-41;;;/h1-24H;2*1H;/q-2;;;+4/p-2
(5)Std. InChIKey: DQQMDUNOVOLBEK-UHFFFAOYSA-L