1,4-Dihydroxyanthraquinone

• CAS: 81-64-1
• Catalog Number: ACM81641
• Category: Organic & Printed Electronics
• Molecular Weight: 240.21g/mol
• Molecular Formula: C14H8O4
• Description: DryPowder
• Synonyms: 1,4-dihydroxy-9,10-anthracenedione;1,4-DIHYDROXYANTHRAQUINONE;1,4 DIHYROXY AQ;DSD ACID;CI NO 58050;CI 58050;LABOTEST-BB LT00052844;PIGMENT VIOLET 12
• IUPAC Name: 1,4-dihydroxyanthracene-9,10-dione
• Canonical SMILES: C1=CC=C2C(=C1)C(=O)C3=C(C=CC(=C3C2=O)O)O
• InChI: InChI=1S/C14H8O4/c15-9-5-6-10(16)12-11(9)13(17)7-3-1-2-4-8(7)14(12)18/h1-6,15-16H
• InChI Key: GUEIZVNYDFNHJU-UHFFFAOYSA-N
• Melting Point: 200.0 °C;196 °C
• Solubility: MODERATELY SOL IN ALCOHOL WITH RED COLOR;SOL IN ETHER WITH BROWN COLOR & YELLOW FLUORESCENCE;SOL WITH VIOLET COLOR IN AQ ALKALIES & IN AMMONIA;1 G SOL IN ABOUT 13 G OF BOILING GLACIAL ACETIC ACID;SOL IN HOT WATER & BENZENE;SOL IN POTASSIUM HYDROXIDE & SULFURIC ACID
• Color/Form: ORANGE CRYSTALS FROM ACETIC ACID; ORANGE PLATES FROM ETHER; DEEP RED NEEDLES FROM ALCOHOL, BENZENE, TOLUENE, XYLENE;YELLOW RED LEAFLETS FROM ETHER; RED CRYSTALS FROM TOLUENE, ACETIC ACID
• Complexity: 342
• Covalently-Bonded Unit Count: 1
• EC Number: 201-368-7
• Exact Mass: 240.042259g/mol
• Formal Charge: 0
• H-Bond Acceptor: 4
• H-Bond Donor: 2
• Heavy Atom Count: 18
• Monoisotopic Mass: 240.042259g/mol
• NSC Number: 646569;229036;40899;15367
• Other Experimental: IR: 16448 (Sadtler Research Laboratories IR Grating Collection) /1,5-Dihydroxyanthraquinone/;UV: 1-545 (Organic Electronic Spectral Data, Phillips et al, John Wiley & Sons, New York) /1,5-Dihydroxyanthraquinone/;MASS: 195 (Aldermaston, Eight Peak Index of Mass Spectra, UK) /1,5-Dihydroxyanthraquinone/;MASS: 195 (Aldermaston, Eight Peak Index of Mass Spectra, UK) /1,7-Dihydroxyanthraquinone/;IR: 5147 (Coblentz Society Spectral Collection) /1,8-Dihydroxyanthraquinone/;UV: 4318 (Sadtler Research Laboratories Spectral Collection) /1,8-Dihydroxyanthraquinone/;MASS: 195 (Aldermaston, Eight Peak Index of Mass Spectra, UK) /1,8-Dihydroxyanthraquinone/;IR: 7239 (Coblentz Society Spectral Collection) /2,6-Dihydroxyanthraquinone/;UV: 1-545 (Organic Electronic Spectral Data, Phillips et al, John Wiley & Sons, New York) /2,6-Dihydroxyanthraquinone/;IR: 3588 (Sadtler Research Laboratories Prism Collection) /2,7-Dihydroxyanthraquinone/
• Rotatable Bond Count: 0
• Stability: BLACK PPT WITH CO2; SUBLIMES @ HIGH VACUUM
• UNII: 8S496ZV3CS
• Vapor Pressure: 2.43e-08 mmHg
• XLogP3: 3.7

Custom Q&A

What is the PubChem CID for 1,4-Dihydroxyanthraquinone?

The PubChem CID for 1,4-Dihydroxyanthraquinone is 6688.

What is the molecular formula of 1,4-Dihydroxyanthraquinone?

The molecular formula of 1,4-Dihydroxyanthraquinone is C14H8O4.

What is the molecular weight of 1,4-Dihydroxyanthraquinone?

The molecular weight of 1,4-Dihydroxyanthraquinone is 240.21 g/mol.

Where is 1,4-Dihydroxyanthraquinone found in nature?

1,4-Dihydroxyanthraquinone is found in Rubia tinctorum and Senna obtusifolia.

What is the IUPAC name of 1,4-Dihydroxyanthraquinone?

The IUPAC name of 1,4-Dihydroxyanthraquinone is 1,4-dihydroxyanthracene-9,10-dione.

What is the CAS number of 1,4-Dihydroxyanthraquinone?

The CAS number of 1,4-Dihydroxyanthraquinone is 81-64-1.

How many hydrogen bond donor counts does 1,4-Dihydroxyanthraquinone have?

1,4-Dihydroxyanthraquinone has 2 hydrogen bond donor counts.

How many hydrogen bond acceptor counts does 1,4-Dihydroxyanthraquinone have?

1,4-Dihydroxyanthraquinone has 4 hydrogen bond acceptor counts.

How many rotatable bond counts does 1,4-Dihydroxyanthraquinone have?

1,4-Dihydroxyanthraquinone has 0 rotatable bond counts.

What is the topological polar surface area (TPSA) of 1,4-Dihydroxyanthraquinone?

The topological polar surface area (TPSA) of 1,4-Dihydroxyanthraquinone is 74.6Ų.