Products for Research Use Only
RegisterLogin

3,4,5-Trichlorocatechol

CAT: 0804-HY-133598-01Size: 5 mgDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:0804-HY-133598-01Size:5 mg
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
Description
3,4,5-Trichlorocatechol is a catechol derivative of pentachlorophenol and induces oxidative DNA lesions[1].
CAS Number
56961-20-7
UNSPSC
12352005
Target
DNA/RNA Synthesis
Type
Reference compound
Related Pathways
Cell Cycle/DNA Damage
Applications
Cancer-programmed cell death
Field of Research
Cancer
Assay Protocol
https://www.medchemexpress.com/3-4-5-trichlorocatechol.html
Solubility
10 mM in DMSO
Smiles
OC1=CC(Cl)=C(Cl)C(Cl)=C1O
Molecular Formula
C6H3Cl3O2
Molecular Weight
213.45
References & Citations
[1]Chia-Hua Lin, et al. Induction of cytotoxicity, aldehydic DNA lesions, and poly (ADP-ribose) polymerase-1 activation by catechol derivatives of pentachlorophenol in calf thymus DNA and in human breast cancer cells. Chem Res Toxicol. 2005 Feb;18 (2) :257-64.
Shipping Conditions
Room temperature
Scientific Category
Reference compound1
Clinical Information
No Development Reported

Chemical Information

3,4,5-Trichlorocatechol
CAS Number56961-20-7
PubChem CID32816
IUPAC Name3,4,5-trichlorobenzene-1,2-diol
Molecular FormulaC6H3Cl3O2
Molecular Weight213.4
XLogP3.2
Topological Polar Surface Area40.5
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count2
Rotatable Bond Count0
Heavy Atom Count11
Formal Charge0
Complexity144
SMILES
C1=C(C(=C(C(=C1Cl)Cl)Cl)O)O
InChI
InChI=1S/C6H3Cl3O2/c7-2-1-3(10)6(11)5(9)4(2)8/h1,10-11H
InChIKey
FUTDYIMYZIMPBJ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 3,4,5-Trichlorocatechol
CAS: 56961-20-7
CID: 32816
Formula: C6H3Cl3O2
MW: 213.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight213.4
XLogP33.2
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count2
Rotatable Bond Count0
Exact Mass211.919862
Monoisotopic Mass211.919862
Topological Polar Surface Area40.5 Ų
Heavy Atom Count11
Formal Charge0
Complexity144
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

Related Products

CatalogName
HY-133610-013,4,6-Trichlorocatechol
HY-N119995,4'-Dihydroxy-3,4,3'-trimethoxybibenzyl
HY-166894S3,3′,4,4′,5,5′-Hexabromo diphenyl ether-13C12
HY-W012777S3,5-Dimethyl-d6-cyclohexanone-3,4,4,5-d4
HY-1574445,3',4',3'',4'',5''-6-O-Ethyl-EGCG
HY-151085S3,4,5-Trichlorobiphenyl-2′,3′,4′,5′,6′-d5
HY-166925S2′,3,3′,4′,5,5′-Hexachloro-4-biphenylol-13C12
HY-W009886-013,4,5-Trimethoxybenzaldehyde
HY-1336013,4,5-Trichloroguaiacol
HY-119166-013,5,4'-Tribromosalicylanilide

Alternative Products

CatalogName
RM-C030503-013,4,5-Trichlorocatechol
RM-C030519-013,4,6-Trichlorocatechol
PC54333,3,4,4,5,5,5-Heptafluoropentanal
FH146375-013,3'4,4'5,5'-Hexabromobiphenyl
427188-013,4,5,3',4',5'-Hexabromobiphenyl
TRC-H295058-250MG3,3',4,4',5,5'-Hexachlorobiphenyl
AR-B07324-013,3',4,4',5,5'-Hexabromodiphenyl
PBA63531-012,3,3',4,4',5,5'-Heptachlorobiphenyl
433578-014,4'-Diamino-3,3',5,5'-tetrabromobiphenyl
TRC-A633024-10MG4-Aminopiperidine-3,3,4,5,5-d5

Popular Products