Products for Research Use Only
RegisterLogin

2-Chlorounguinol

CAT: 0013-GTR19227698-02Size: 2 mgDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:0013-GTR19227698-02Size:2 mg
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
Description
2-Chlorounguinol (CAS 117032-57-2) is a research chemical employed in life science studies. It serves as a useful tool compound for biochemical research, with applications in both in vitro enzymatic assays and in vivo model organism studies to investigate biological pathways.
CAS Number
117032-57-2
Smiles
C\C=C (\C) c1cc (O) c (C) c2OC (=O) c3c (C) c (Cl) c (O) cc3Oc12
Molecular Formula
C19H17ClO5
Molecular Weight
360.79
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

2-Chlorounguinol

2-Chlorounguinol is a carbonyl compound.

CAS Number117032-57-2
PubChem CID6477039
IUPAC Name1-[(Z)-but-2-en-2-yl]-8-chloro-3,9-dihydroxy-4,7-dimethylbenzo[b][1,4]benzodioxepin-6-one
Molecular FormulaC19H17ClO5
Molecular Weight360.8
XLogP5.2
Topological Polar Surface Area76
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count1
Heavy Atom Count25
Formal Charge0
Complexity550
SMILES
C/C=C(/C)\C1=CC(=C(C2=C1OC3=C(C(=C(C(=C3)O)Cl)C)C(=O)O2)C)O
InChI
InChI=1S/C19H17ClO5/c1-5-8(2)11-6-12(21)9(3)17-18(11)24-14-7-13(22)16(20)10(4)15(14)19(23)25-17/h5-7,21-22H,1-4H3/b8-5-
InChIKey
KZPINWADEGOBQG-YVMONPNESA-N
Chemical Structure
2D Structure
2D structure of 2-Chlorounguinol
CAS: 117032-57-2
CID: 6477039
Formula: C19H17ClO5
MW: 360.8
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight360.8
XLogP35.2
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count1
Exact Mass360.0764513
Monoisotopic Mass360.0764513
Topological Polar Surface Area76 Ų
Heavy Atom Count25
Formal Charge0
Complexity550
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count1
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Related Products

CatalogName
GTR19170856-012,2,2-Trichloroethanol
GTR19216509-012,2,2-Trichloroethanol
GTR19255109-012,2,2-Trifluoroacetamide
GTR19166705-012-[2- (2,2,2-Trifluoroethoxy) phenoxy]ethyl methanesulfonate
GTR19228240-012-[2- (2,2,2-Trifluoroethoxy) phenoxy]ethyl bromide
GTR19216331-012-[2- (2,2,2-Trifluoroethoxy) phenoxy]ethyl methanesulfonate
GTR19243300-012,2-Dibromo-2-cyanoacetamide
GTR19169550-012,2':5',2''-Terthiophene
GTR19254763-012,2':6',2''-Terpyridine
GTR19266996-012,2'-Azobis[2- (2-imidazolin-2-yl) propane] dihydrochloride

Alternative Products

CatalogName
T126299-012-Chlorounguinol
H 038-0052'- , 2''-, 2''', 2'''', 2''''', 2''''''- Hexadeoxy- 2'-, 2'', 2''', 2'''', 2''''', 2''''''- hexafluoro- cyclic hexaadenosine monophosphate (2',2'',2''',2'''',2''''',2''''''-Hexa-F-c-hexadAMP / cFA6), sodium salt
PC1003049-012,2,2-Trifluoroethyl 2,2,2-trichloroacetate
OR1009873-012,2,2,2-Ethylenedinitrilotetraethanol
PC32719-012,2,2,2'-Tetrafluoroacetophenone
TRC-T790200-50MG2,2,2-Trifluoroethyl 2,5-Bis(2,2,2-trifluoroethoxy)benzoate
MBS6106553-012,2,2-Trifluoroethyl 2-Hydroxy-5-(2,2,2-trifluoroethoxy)benzoate
D443501Diethyl-2,2,2,2',2',2'-d6-amine HCl
TRC-T790195-25G2-[2-(2,2,2-Trifluoroethoxy)phenoxy]-ethanol
sc-4746732-[2- (2,2,2-Trifluoroethoxy) phenoxy]-ethanol

Popular Products