2-Anilino-3-methyl-6-(dibutylamino)fluoran

Basic Information

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CAS Number

89331-94-2

Molecular Formula

C35H36N2O3

Molecular Weight

532.68 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Esters

Basic Chemical Raw Materials Organic Chemicals Ethers

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Surfactants Anionic Surfactants

Laboratory Chemicals Research Chemicals Biochemical Reagents

Basic Physical Properties

Melting Point

179-184 ºC

Boiling Point

704.5°C at 760 mmHg

SMILES

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CCCCN(CCCC)C1=CC2=C(C=C1)C3(C4=CC=CC=C4C(=O)O3)C5=C(O2)C=C(C(=C5)NC6=CC=CC=C6)C

InChI

InChI=1S/C35H36N2O3/c1-4-6-19-37(20-7-5-2)26-17-18-29-33(22-26)39-32-21-24(3)31(36-25-13-9-8-10-14-25)23-30(32)35(29)28-16-12-11-15-27(28)34(38)40-35/h8-18,21-23,36H,4-7,19-20H2,1-3H3

InChIKey

XAAILNNJDMIMON-UHFFFAOYSA-N

LogP

8.713220000000005

Topological Polar Surface Area

50.8 Å²

Hydrogen Bond Donor/Acceptor

1 / 5

Complexity

837

Safety Information

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GHS Hazard Pictograms

H302

Hazard Statement

H302 Harmful if swallowed
Acute toxicity, oral

Synonyms & References

English

6'-(Dibutylamino)-3'-methyl-2'-(phenylamino)-3H-spiro[isobenzofuran-1,9'-xanthen]-3-one
ODB-2
odb-two
CK-68
Heat(Pressure) Senditive Black TF-BL3
Spiro[isobenzofuran-1(3H),9'-[9H]xanthen]-3-one,6'-(dibutylamino)-3'-methyl-2'-phenylamino-
PSD-290
2-Phenylamino-3-methyl-6-di-n-butylaminofluoran
3-Di-n-butylamino-6-methyl-7-phenylaminofluoran
2'-anilino-6'-(dibutylamino)-3'-methylspiro[2-benzofuran-3,9'-xanthene]-1-one
2-ANILINO-6-DIBUTYLAMINO-3-METHYLFLUORAN
6'-(Dibutylamino)-3'-methyl-2'-(phenylamino)-spiro[isobenzofuran-1(3H),9'-[9H]xanthen]-3-one
2-Anilino-3-methyl-6-(dibutylamino)fluoran
2-Anilino-6-(dibutylamino)-3-methylfluoran
AK139961
Spiro[isobenzofuran-1(3H),9'-[9H]xanthen]-3-one-6'-(dibutylamino)-3'-methyl-2'-(phenylamino)-
C35H36N2O3
2'-anilino-6'-(dibutylamino)-3'-methyl-3H-spiro[2-benzofuran-1,9'-xanthen]-3-one
6'-(dibutylamino)-3'-methyl-2'-
CK-68;3-DI-N-BUTYLAMINO-6-METHYL-7-PHENYLAMINOFLUORAN
6′-(Dibutylamino)-3′-methyl-2′-(phenylamino)spiro[isobenzofuran-1(3H),9′-[9H]xanthen]-3-one (ACI)
2-Anilino-3-methyl-6-(di-n-butylamino)fluoran
2-Anilino-6-di-n-butylamino-3-methylfluoran
2-Anilino-6-dibutylamino-3-methylfluoran
2-Phenylamino-3-methyl-6-(di-n-butylamino)fluorane
2′-Anilino-3′-methyl-6′-(dibutylamino)fluoran
2′-Anilino-6′-(dibutylamino)-3′-methylspiro[2-benzofuran-3,9′-xanthene]-1-one
3-Di-n-butylamino-6-methyl-7-anilinofluoran
3-Dibutylamino-6-methyl-7-anilinofluoran
3-Dibutylamino-6-methyl-7-phenylaminofluoran
3′-(Dibutylamino)-6′-methyl-7′-anilinofluoran

MDL Number

MFCD00307579

FAQ

What is 2-Anilino-3-methyl-6-(dibutylamino)fluoran (CAS: 89331-94-2)?

2-Anilino-3-methyl-6-(dibutylamino)fluoran (CAS: 89331-94-2) is an organic compound with the chemical formula C18H25NO2. It features a fluoran core with substituents including anilino, methyl, and dibutylamino groups. This compound is typically a yellow solid, known for its solubility in polar organic solvents and its role as a fluorescent dye precursor in chemical synthesis.

What are the main uses of 2-Anilino-3-methyl-6-(dibutylamino)fluoran (CAS: 89331-94-2)?

2-Anilino-3-methyl-6-(dibutylamino)fluoran (CAS: 89331-94-2) is primarily used in pharmaceutical research as an intermediate for dye and pigment synthesis. It finds applications in industrial sectors for creating colored compounds and in scientific studies for fluorescence-based assays. Its versatility makes it relevant in chemical research and specialty material development.

Is 2-Anilino-3-methyl-6-(dibutylamino)fluoran (CAS: 89331-94-2) safe?

2-Anilino-3-methyl-6-(dibutylamino)fluoran (CAS: 89331-94-2) is generally considered safe when handled properly. However, standard safety precautions include avoiding skin contact, inhalation, and ingestion. Protective measures like gloves and ventilation are recommended. It is not classified as highly toxic, but adherence to chemical safety guidelines is essential for safe use.

How should 2-Anilino-3-methyl-6-(dibutylamino)fluoran (CAS: 89331-94-2) be stored?

2-Anilino-3-methyl-6-(dibutylamino)fluoran (CAS: 89331-94-2) should be stored in a cool, dry place (ideally below 25°C) away from light. It is best kept in sealed, airtight containers to maintain stability and prevent contamination. Avoid exposure to moisture and ensure storage conditions comply with standard chemical safety protocols for long-term preservation.