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Serratol

CAT: 0498-bs-75248CSize: 5 mgDry Ice: NoHazardous: No
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CAT#:0498-bs-75248CSize:5 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
67814-27-1
Conjugation
Unconjugated
Purity
>95% (HPLC)
Buffer
Oil
Solubility
Soluble in DMSO, dichloromethane or ethyl ether. Insoluble in water. Almost insoluble in ethanol or methanol.
Smiles
C/C1=C\CC/C(C)=C/C[C@](O)(C(C)C)CC/C(C)=C/CC1
Molecular Formula
C20H34O
Molecular Weight
290.5
Storage Conditions
Stable for 2 years after receipt when stored at -20°C.
Appearance
Oil.

Chemical Information

Cembrenol
CAS Number67814-27-1
PubChem CID10979156
IUPAC Name(3E,7E,11E)-4,8,12-trimethyl-1-propan-2-ylcyclotetradeca-3,7,11-trien-1-ol
Molecular FormulaC20H34O
Molecular Weight290.5
XLogP4.8
Topological Polar Surface Area20.2
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count1
Heavy Atom Count21
Formal Charge0
Complexity412
SMILES
C/C/1=C\CC/C(=C/CC(CC/C(=C/CC1)/C)(C(C)C)O)/C
InChI
InChI=1S/C20H34O/c1-16(2)20(21)14-12-18(4)10-6-8-17(3)9-7-11-19(5)13-15-20/h8,11-12,16,21H,6-7,9-10,13-15H2,1-5H3/b17-8+,18-12+,19-11+
InChIKey
ZVWXZFYWLABNOW-GDVLXBNMSA-N
Chemical Structure
2D Structure
2D structure of Cembrenol
CAS: 67814-27-1
CID: 10979156
Formula: C20H34O
MW: 290.5
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight290.5
XLogP34.8
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count1
Exact Mass290.260965704
Monoisotopic Mass290.260965704
Topological Polar Surface Area20.2 Ų
Heavy Atom Count21
Formal Charge0
Complexity412
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count3
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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