Cyclofenil

CAT: 0926-FC20687-01Size: 250 mgDry Ice: NoHazardous: No

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CAT#:0926-FC20687-01Size:250 mg

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CAS Number

2624-43-3

Synonyms

4,4'- (Cyclohexylidenemethylene) bisphenol 1,1'-diacetate;4,4'- (Cyclohexylidenemethylene) diphenol diacetate ester

Smiles

CC (=O) OC1=CC=C (C=C1) C (=C2CCCCC2) C3=CC=C (C=C3) OC (=O) C

Molecular Formula

C23H24O4

Molecular Weight

364.43 g/mol

Controlled

Chemical Information

Cyclofenil

Cyclofenil is an organic molecular entity.

CAS Number	2624-43-3
PubChem CID	2898
IUPAC Name	[4-[(4-acetyloxyphenyl)-cyclohexylidenemethyl]phenyl] acetate
Molecular Formula	C23H24O4
Molecular Weight	364.4
XLogP	5.5
Topological Polar Surface Area	52.6
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	6
Heavy Atom Count	27
Formal Charge	0
Complexity	503

SMILES

CC(=O)OC1=CC=C(C=C1)C(=C2CCCCC2)C3=CC=C(C=C3)OC(=O)C

InChI

InChI=1S/C23H24O4/c1-16(24)26-21-12-8-19(9-13-21)23(18-6-4-3-5-7-18)20-10-14-22(15-11-20)27-17(2)25/h8-15H,3-7H2,1-2H3

InChIKey

GVOUFPWUYJWQSK-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 2624-43-3

CID: 2898

Formula: C23H24O4

MW: 364.4

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	364.4
XLogP3	5.5
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	6
Exact Mass	364.16745924
Monoisotopic Mass	364.16745924
Topological Polar Surface Area	52.6 Å²
Heavy Atom Count	27
Formal Charge	0
Complexity	503
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
VAA00787-01	Cyclopenin