13,6-(EPITHIOIMINO)PENTACENE-16-CARBOXYLIC ACID, 6,13-DIHYDRO-, TERT BUTYL ESTER, 15-OXIDE
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13,6-(EPITHIOIMINO)PENTACENE-16-CARBOXYLIC ACID, 6,13-DIHYDRO-, TERT BUTYL ESTER, 15-OXIDE
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CAS No:
794586-44-0
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Formula:
C27H23NO3S
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Chemical Name:
13,6-(EPITHIOIMINO)PENTACENE-16-CARBOXYLIC ACID, 6,13-DIHYDRO-, TERT BUTYL ESTER, 15-OXIDE
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Synonyms:
Pentacene-N-sulfinyl-tert-butylcarbamate;13,6-(Epithioimino)pentacene-16-carboxylic acid,6,13-dihydro-,tert butyl ester,15-oxide;SCHEMBL11991189;DTXSID50728601;Pentacene-N-sulfinyl-tert-butylcarbamate, 99% (HPLC);6,13-(tert-Butoxycarbonyliminosulfinyl)-6,13-dihydropentacene;6alpha,13alpha-(tert-Butoxycarbonyliminosulfinyl)-6,13-dihydropentacene;tert-Butyl 16-oxo-6,13-dihydro-6,13-(epithioimino)pentacene-15-carboxylate
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CAS No:
13,6-(EPITHIOIMINO)PENTACENE-16-CARBOXYLIC ACID, 6,13-DIHYDRO-, TERT BUTYL ESTER, 15-OXIDE Basic Attributes
441.549
441.14000
DTXSID50728601
Safety Information
UN 3077 9 / PGIII
3
50/53
60-61
N
P273
H400
|Warning|H400 (100%): Very toxic to aquatic life [Warning Hazardous to the aquatic environment, acute hazard]|P273, P391, and P501|Aggregated GHS information provided by 38 companies from 1 notifications to the ECHA C&L Inventory.
13,6-(EPITHIOIMINO)PENTACENE-16-CARBOXYLIC ACID, 6,13-DIHYDRO-, TERT BUTYL ESTER, 15-OXIDE Use and Manufacturing
Photo-patternable pentacene precursor that is easily soluble in non-polar organic solvents (halogenated solvents, THF). It can be converted to pentacene by heating at 150°C under N2 for 1 hour in a thin (eg spin-cast) film. The spin-coated pentacene precursor film can be patterned by exposure to ultraviolet light in the presence of a photoacid generator (such as 531014), followed by brief heating (130°C for 5 minutes) and washing off the unconverted precursor Change. The organic thin film transistor manufactured by solution processing of the precursor exhibits a mobility of 0.13 cm 2 V-1s-1 and a switching ratio of 2 mM105.
Computed Properties
Molecular Weight:441.5
XLogP3:5.7
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:2
Exact Mass:441.13986477
Monoisotopic Mass:441.13986477
Topological Polar Surface Area:65.8
Heavy Atom Count:32
Complexity:737
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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13,6-(EPITHIOIMINO)PENTACENE-16-CARBOXYLIC ACID, 6,13-DIHYDRO-, TERT BUTYL ESTER, 15-OXIDE
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