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P, p'-DDMS

CAT: 0013-GTR19210466-02Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19210466-02Size:50 mg
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Description
P, p'-DDMS is a water-soluble, highly selective inhibitor of cytochrome P450 omega-hydroxylase. It is a valuable research tool for investigating the role of omega-hydroxylated eicosanoids, such as 20-HETE, in vascular and renal physiology and pathophysiology in both in vitro and in vivo models.
CAS Number
2642-80-0
Smiles
C (CCl) (C1=CC=C (Cl) C=C1) C2=CC=C (Cl) C=C2
Molecular Formula
C14H11Cl3
Molecular Weight
285.6
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

p,p'-DDMS

1-chloro-2,2-bis(4-chlorophenyl)ethane is a chlorophenylethane and a member of monochlorobenzenes.

CAS Number2642-80-0
PubChem CID17532
IUPAC Name1-chloro-4-[2-chloro-1-(4-chlorophenyl)ethyl]benzene
Molecular FormulaC14H11Cl3
Molecular Weight285.6
XLogP5.6
Topological Polar Surface Area0
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count0
Rotatable Bond Count3
Heavy Atom Count17
Formal Charge0
Complexity194
SMILES
C1=CC(=CC=C1C(CCl)C2=CC=C(C=C2)Cl)Cl
InChI
InChI=1S/C14H11Cl3/c15-9-14(10-1-5-12(16)6-2-10)11-3-7-13(17)8-4-11/h1-8,14H,9H2
InChIKey
CHBOSHOWERDCMH-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of p,p'-DDMS
CAS: 2642-80-0
CID: 17532
Formula: C14H11Cl3
MW: 285.6
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight285.6
XLogP35.6
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count0
Rotatable Bond Count3
Exact Mass283.992633
Monoisotopic Mass283.992633
Topological Polar Surface Area0 Ų
Heavy Atom Count17
Formal Charge0
Complexity194
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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