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S-Hydroprene (>90%)

CAT: 0572-TRC-H714720-50MGSize: 50 mgDry Ice: NoHazardous: No
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CAT#:0572-TRC-H714720-50MGSize:50 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
65733-18-8
Hazard Statement
Very toxic to aquatic life; UN number: UN3082; Packing Group: III
Smiles
CCOC(=O)\C=C(/C)\C=C\C[C@@H](C)CCCC(C)C
Molecular Formula
C17 H30 O2
Molecular Weight
266.42
InChI
InChI=1S/C17H30O2/c1-6-19-17(18)13-16(5)12-8-11-15(4)10-7-9-14(2)3/h8,12-15H,6-7,9-11H2,1-5H3/b12-8+,16-13+/t15-/m0/s1
Additionnal Information
IUPAC name: ethyl (2E,4E,7S)-3,7,11-trimethyldodeca-2,4-dienoate
Shipping Conditions
Room Temperature
Storage Conditions
+4°C

Chemical Information

S-Hydroprene

(S)-hydroprene is a hydroprene. It is an enantiomer of a (R)-hydroprene.

CAS Number65733-18-8
PubChem CID5282198
IUPAC Nameethyl (2E,4E,7S)-3,7,11-trimethyldodeca-2,4-dienoate
Molecular FormulaC17H30O2
Molecular Weight266.4
XLogP6.2
Topological Polar Surface Area26.3
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count10
Heavy Atom Count19
Formal Charge0
Complexity300
SMILES
CCOC(=O)/C=C(\C)/C=C/C[C@@H](C)CCCC(C)C
InChI
InChI=1S/C17H30O2/c1-6-19-17(18)13-16(5)12-8-11-15(4)10-7-9-14(2)3/h8,12-15H,6-7,9-11H2,1-5H3/b12-8+,16-13+/t15-/m0/s1
InChIKey
FYQGBXGJFWXIPP-OJROSNHMSA-N
Chemical Structure
2D Structure
2D structure of S-Hydroprene
CAS: 65733-18-8
CID: 5282198
Formula: C17H30O2
MW: 266.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight266.4
XLogP36.2
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count10
Exact Mass266.224580195
Monoisotopic Mass266.224580195
Topological Polar Surface Area26.3 Ų
Heavy Atom Count19
Formal Charge0
Complexity300
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count2
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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