Synonyms: | Tin,dichloro[29H,31H-phthalocyaninato(2-)-N29,N30,N31,N32]-, (OC-6-12)-;Tin,dichloro[phthalocyaninato(2-)]- (7CI,8CI);Dichloro(phthalocyaninato)tin;Dichloro[phthalocyaninato(2-)]tin;Dichlorotinphthalocyanine; |
InChI: | InChI=1/C32H16N8.2ClH.Sn/c1-2-10-18-17(9-1)25-33-26(18)38-28-21-13-5-6-14-22(21)30(35-28)40-32-24-16-8-7-15-23(24)31(36-32)39-29-20-12-4-3-11-19(20)27(34-29)37-25;;;/h1-16H;2*1H;/q-2;;;+4/p-2/rC32H16Cl2N8Sn/c33-43(34)41-29-21-13-5-6-14-22(21)31(41)39-27-19-11-3-4-12-20(19)28(36-27)40-32-24-16-8-7-15-23(24)30(42(32)43)38-26-18-10-2-1-9-17(18)25(35-26)37-29/h1-16H/b37-25-,37-29-,38-26-,38-30-,39-27-,39-31-,40-28-,40-32- |
Specification: |
The CAS register number of Tin(IV) phthalocyanine dichloride is 18253-54-8. It also can be called as Tin,dichloro[29H,31H-phthalocyaninato(2-)-kN29,kN30,kN31,kN32]-, (OC-6-12)-. The molecular formula about this chemical is C32H16Cl2N8Sn and the molecular weight is 702.13. It belongs to the following product categories, such as Classes of Metal Compounds; Functional Materials; Phthalocyanines; Phthalonitriles & Naphthalonitriles; Sn (Tin) Compounds; Typical Metal Compounds; Stains and Dyes; Stains&Dyes, A to; T-U-V and so on. This chemical is irritating to eyes, respiratory system and skin. When you are using it, please avoid contact with skin and eyes.
Physical properties about Tin(IV) phthalocyanine dichloride are: (1)#H bond acceptors: 8; (2)Polar Surface Area: 82.33Å2; (3)H-Bond Acceptor: 7; (4)Rotatable Bond Count 0; (5)Exact Mass: 701.989695; (6)MonoIsotopic Mass: 701.989695; (7)Topological Polar Surface Area: 82.3; (8)Heavy Atom Count: 43; (9)Complexity: 1170; (10)Covalently-Bonded Unit Count: 1.
You can still convert the following datas into molecular structure:
(1)SMILES: c1cc2c/3n4c(c2cc1)/nc/5\nc(/nc/6\n(/c(n\c-7n/c(n3)/c8c7cccc8)/c9c6cccc9)[Sn]4(Cl)Cl)-c1c5cccc1
(2)InChI: InChI=1/C32H16N8.2ClH.Sn/c1-2-10-18-17(9-1)25-33-26(18)38-28-21-13-5-6-14-22(21)30(35-28)40-32-24-16-8-7-15-23(24)31(36-32)39-29-20-12-4-3-11-19(20)27(34-29)37-25;;;/h1-16H;2*1H;/q-2;;;+4/p-2/rC32H16Cl2N8Sn/c33-43(34)41-29-21-13-5-6-14-22(21)31(41)39-27-19-11-3-4-12-20(19)28(36-27)40-32-24-16-8-7-15-23(24)30(42(32)43)38-26-18-10-2-1-9-17(18)25(35-26)37-29/h1-16H/b37-25-,37-29-,38-26-,38-30-,39-27-,39-31-,40-28-,40-32-
(3)InChIKey: BBRNKSXHHJRNHK-NOEVKUNVBL
(4)Std. InChI: InChI=1S/C32H16N8.2ClH.Sn/c1-2-10-18-17(9-1)25-33-26(18)38-28-21-13-5-6-14-22(21)30(35-28)40-32-24-16-8-7-15-23(24)31(36-32)39-29-20-12-4-3-11-19(20)27(34-29)37-25;;;/h1-16H;2*1H;/q-2;;;+4/p-2
(5)Std. InChIKey: BBRNKSXHHJRNHK-UHFFFAOYSA-L
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