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2,3,4-Trihydroxybenzophenone 99%

CAT: 0286-T24696-02Size: 100 gDry Ice: NoHazardous: No
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CAT#:0286-T24696-02Size:100 g
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CAS Number
1143-72-2
Pictogram
07 - Irritant
UDF Signal Word
Warning
MDL Number
MFCD00009996
Hazard Statement
H302 Harmful if swallowed; H312 Harmful in contact with skin; H315 Causes skin irritation; H319 Causes serious eye irritation; H332 Harmful if inhaled; H335 May cause respiratory irritation.
DOT Name
Not D.O.T.-Regulated
Precautions
P261 Avoid breathing dust/fume/gas/mist/vapors/spray; P280 Wear protective gloves/protective clothing/eye protection/face protection; P301+P312 IF SWALLOWED: call a POISON CENTER or doctor/physician IF you feel unwell; P302+P352 IF ON SKIN: wash with plenty of soap and water; P304+P340 IF INHALED: Remove victim to fresh air and Keep at rest in a position comfortable for breathing; P305+P351+P338 IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue rinsing; P332+P313 IF SKIN irritation occurs: Get medical advice/attention.

Chemical Information

Alizarin Yellow A

2,3,4-trihydroxbenzophenone is a benzenetriol that is benzophenone in which one of the phenyl groups is substituted by hydroxy groups at positions 2, 3, and 4. It is a redox mediator. It has a role as a quorum sensing inhibitor, a drug metabolite, an EC 1.14.18.1 (tyrosinase) inhibitor, a human urinary metabolite and a rat metabolite. It is a benzenetriol and a hydroxybenzophenone.

CAS Number1143-72-2
PubChem CID70837
IUPAC Namephenyl-(2,3,4-trihydroxyphenyl)methanone
Molecular FormulaC13H10O4
Molecular Weight230.22
XLogP2.8
Topological Polar Surface Area77.8
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count4
Rotatable Bond Count2
Heavy Atom Count17
Formal Charge0
Complexity273
SMILES
C1=CC=C(C=C1)C(=O)C2=C(C(=C(C=C2)O)O)O
InChI
InChI=1S/C13H10O4/c14-10-7-6-9(12(16)13(10)17)11(15)8-4-2-1-3-5-8/h1-7,14,16-17H
InChIKey
HTQNYBBTZSBWKL-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Alizarin Yellow A
CAS: 1143-72-2
CID: 70837
Formula: C13H10O4
MW: 230.22
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight230.22
XLogP32.8
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count4
Rotatable Bond Count2
Exact Mass230.05790880
Monoisotopic Mass230.05790880
Topological Polar Surface Area77.8 Ų
Heavy Atom Count17
Formal Charge0
Complexity273
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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Alternative Products

CatalogName
sc-2256272,3,4-Trihydroxybenzophenone
sc-2310052,4,4'-Trihydroxybenzophenone
HY-D0272S-012,3,4-Trihydroxybenzophenone-d5
FT70586-012,4,6-Trihydroxybenzophenone
HY-N1868-013-Prenyl-2,4,6-trihydroxybenzophenone
419920-012,3,4-Trihydroxybenzophenone-2’,3’,4’,5’,6’-d5
sc-4756372,3,4-Trihydroxybenzophenone-2′,3′,4′,5′,6′-d5
GTR191834013- (3-Hydroxy-3-methylbutanyl) -2,4,6-trihydroxybenzophenone
MBS57614373-(3-Hydroxy-3-methylbutanyl)-2,4,6-trihydroxybenzophenone
68510-93-02,3,4-Trihydroxybenzophenone naphthoquinone-1,2-diazido-5-sulfonate

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