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432962

Sigma-Aldrich

Vanadyl 2,11,20,29-tetra-tert-butyl-2,3-naphthalocyanine

Dye content 95 %

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Empirical Formula (Hill Notation):
C64H56N8OV
CAS Number:
105011-00-5
Molecular Weight:
1004.12
MDL number:
MFCD00216604
UNSPSC Code:
12352103
PubChem Substance ID:
24867110
NACRES:
NA.23

form

solid

composition

Dye content, 95%

mp

>300 °C (lit.)

λmax

808 nm

SMILES string

CC(C)(C)c1ccc2cc3c4nc(nc5n6[V](=O)n7c(nc8nc(nc6c9cc%10cc(ccc%10cc59)C(C)(C)C)c%11cc%12ccc(cc%12cc8%11)C(C)(C)C)c%13cc%14ccc(cc%14cc%13c7n4)C(C)(C)C)c3cc2c1

InChI

1S/C64H56N8.O.V/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

InChI key

KYDACBKVLZCERN-UHFFFAOYSA-N

WGK

WGK 3

Flash Point(F)

Not applicable

Flash Point(C)

Not applicable

Certificates of Analysis (COA)

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