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Chlorfenethol

CAT: 0931-T20930-01Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0931-T20930-01Size:25 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
80-06-8
Target
Others
Related Pathways
Others
Bioactivity
Chlorfenethol is a biomedical.
Smiles
ClC1=CC=C(C=C1)C(O)(C2=CC=C(Cl)C=C2)C
Molecular Formula
C14H12Cl2O
Molecular Weight
267.15
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

1,1-Bis(4-chlorophenyl)ethanol

Chlorfenethol is a diarylmethane.

CAS Number80-06-8
PubChem CID6624
IUPAC Name1,1-bis(4-chlorophenyl)ethanol
Molecular FormulaC14H12Cl2O
Molecular Weight267.1
XLogP2.8
Topological Polar Surface Area20.2
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count2
Heavy Atom Count17
Formal Charge0
Complexity219
SMILES
CC(C1=CC=C(C=C1)Cl)(C2=CC=C(C=C2)Cl)O
InChI
InChI=1S/C14H12Cl2O/c1-14(17,10-2-6-12(15)7-3-10)11-4-8-13(16)9-5-11/h2-9,17H,1H3
InChIKey
URYAFVKLYSEINW-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 1,1-Bis(4-chlorophenyl)ethanol
CAS: 80-06-8
CID: 6624
Formula: C14H12Cl2O
MW: 267.1
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight267.1
XLogP32.8
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count2
Exact Mass266.0265204
Monoisotopic Mass266.0265204
Topological Polar Surface Area20.2 Ų
Heavy Atom Count17
Formal Charge0
Complexity219
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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