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[(2Z,14Z,27Z,41Z)-8,21,34,47-Tetrakis(2-methyl-2-propanyl)-2,15,28,41,53,54,55,56-octaazatridecacyclo[40.10.1.1 | CAS No. 39049-43-9

[(2Z,14Z,27Z,41Z)-8,21,34,47-Tetrakis(2-methyl-2-propanyl)-2,15,28,41,53,54,55,56-octaazatridecacyclo[40.10.1.1

Basic Information

Chemical_Structure_Of

CAS Number

39049-43-9

Molecular Formula

C64H56N8Zn

Molecular Weight

1002.6 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Fine Chemicals Dyes and Pigments Organic Dyes

Laboratory Chemicals Research Chemicals Biochemical Reagents

Basic Physical Properties

Melting Point

>300 °C

SMILES

CC(C)(C)c1ccc2cc3c(cc2c1)c4/nc/5\nc(/nc\6/c7cc8ccc(cc8cc7c9/n6[Zn]n4c3/nc/1\nc(\n9)-c2c1cc1cc(ccc1c2)C(C)(C)C)C(C)(C)C)-c1c5cc2ccc(cc2c1)C(C)(C)C

InChI

InChI=1S/C64H56N8.Zn/c1-61(2,3)41-17-13-33-25-45-49(29-37(33)21-41)57-65-53(45)70-58-51-31-39-23-43(63(7,8)9)19-15-35(39)27-47(51)55(67-58)72-60-52-32-40-24-44(64(10,11)12)20-16-36(40)28-48(52)56(68-60)71-59-50-30-38-22-42(62(4,5)6)18-14-34(38)26-46(50)54(66-59)69-57;/h13-32H,1-12H3;/q-2;+2

InChIKey

QSAQNAXTLSXDAT-UHFFFAOYSA-N

LogP

14.651099999999964

Topological Polar Surface Area

84.02 Å²

Hydrogen Bond Donor/Acceptor

0 / 8

Complexity

1800

Synonyms & References

English

zinc 2,11,20,29-tetra-tert-butyl-2,3-naphthalocyanine
[Zn(OBu(t))2](x)
2-methylpropan-2-olate
ACMC-20aj87
AG-B-56540
AGN-PC-000MP6
bis(t-butoxy) zinc
CTK5I5283
Di-tert-butyloxy-zink
ZINC TERT-BUTOXIDE
zinc tetra(tert-butyl)naphthalocyanine
zinc tetra(tert-butylnaphtho)porphyrazine
Zink-tert-butylat
Zn(O-t-Bu)2
ZINC 2,11,20,29-TETRA-TERT-BUTYL-2,3-NAPHTHALOCYANINE
zinc 2,11,20,29-tetra-tert-butyl-2,3-naphthalocya
Zinc 2,11,20,29-tetra-tert-butyl-2,3-naphthalocyanine Dye content 90 %

MDL Number

MFCD00209625

Related Compounds

(R)-tert-Butyl 3-(4-amino-3-(4-phenoxyphenyl)-1H-pyrazolo[3,4-d]pyrimidin-1-yl)piperidine-1-carboxylate structure

(R)-tert-Butyl 3-(4-amino-3-(4-phenoxyphenyl)-1H-pyrazolo[3,4-d]pyrimidin-1-yl)piperidine-1-carboxylate

CAS Number: 1022150-11-3

Molecular Formula: C27H30N6O3

2-Hydroxy-5-nitro-1H-isoindole-1,3(2H)-dione structure

2-Hydroxy-5-nitro-1H-isoindole-1,3(2H)-dione

CAS Number: 105969-98-0

Molecular Formula: C8H4N2O5

H-Glu(otbu)-nh2 hydrochloride structure

H-Glu(otbu)-nh2 hydrochloride

CAS Number: 108607-02-9

Molecular Formula: C9H19ClN2O3

[(3aS,5R,6S,6aS)-6-Hydroxy-2,2-dimethyltetrahydrofuro[2,3-d][1,3]dioxol-5-yl](4-morpholinyl)methanone (non-preferred name) structure

[(3aS,5R,6S,6aS)-6-Hydroxy-2,2-dimethyltetrahydrofuro[2,3-d][1,3]dioxol-5-yl](4-morpholinyl)methanone (non-preferred name)

CAS Number: 1103738-19-7

Molecular Formula: C12H19NO6

MYO-INOSITOL HEXAKIS(DIHYDROGEN PHOSPHATE), DODECASODIUM SALT HYDRATE structure

MYO-INOSITOL HEXAKIS(DIHYDROGEN PHOSPHATE), DODECASODIUM SALT HYDRATE

CAS Number: 123408-98-0

Molecular Formula: C6H8Na12O25P6

2-Methyl-2-propanyl (3S)-3-cyano-1-pyrrolidinecarboxylate structure

2-Methyl-2-propanyl (3S)-3-cyano-1-pyrrolidinecarboxylate

CAS Number: 132945-78-9

Molecular Formula: C10H16N2O2

(4-Chlorophenyl)(3,4-dihydroxyphenyl)methanone structure

(4-Chlorophenyl)(3,4-dihydroxyphenyl)methanone

CAS Number: 134612-84-3

Molecular Formula: C13H9ClO3

3-(4-Methyl-1-piperazinyl)aniline structure

3-(4-Methyl-1-piperazinyl)aniline

CAS Number: 148546-99-0

Molecular Formula: C11H17N3

(5R)-5-[(4S)-2,2-Dimethyl-1,3-dioxolan-4-yl]-3,4-dihydroxy-2(5H)-furanone structure

(5R)-5-[(4S)-2,2-Dimethyl-1,3-dioxolan-4-yl]-3,4-dihydroxy-2(5H)-furanone

CAS Number: 15042-01-0

Molecular Formula: C9H12O6

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Supplier Information

Shanghai Yinxin Laboratory Equipment Co., Ltd.

CAS Number: 39049-43-9

Shanghai Hansi Chemical Co., Ltd.

CAS Number: 39049-43-9

Shanghai Jixiang Biotechnology Co., Ltd.

CAS Number: 39049-43-9

Admiral Chemicals

CAS Number: 39049-43-9