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(S) -3-Hydroxy-5-Phenylpent-1-Ene

CAT: 1596-AR-B06353-01Size: 10 UnitsDry Ice: NoHazardous: No
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CAT#:1596-AR-B06353-01Size:10 Units
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CAS Number
125637-06-1
Molecular Formula
C11H14O
Molecular Weight
162.23
API Name
Benzene

Chemical Information

(S)-5-phenylpent-1-en-3-ol
CAS Number125637-06-1
PubChem CID9920461
IUPAC Name(3S)-5-phenylpent-1-en-3-ol
Molecular FormulaC11H14O
Molecular Weight162.23
XLogP2.5
Topological Polar Surface Area20.2
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count4
Heavy Atom Count12
Formal Charge0
Complexity125
SMILES
C=C[C@H](CCC1=CC=CC=C1)O
InChI
InChI=1S/C11H14O/c1-2-11(12)9-8-10-6-4-3-5-7-10/h2-7,11-12H,1,8-9H2/t11-/m1/s1
InChIKey
VMUJXKHHANQVNB-LLVKDONJSA-N
Chemical Structure
2D Structure
2D structure of (S)-5-phenylpent-1-en-3-ol
CAS: 125637-06-1
CID: 9920461
Formula: C11H14O
MW: 162.23
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight162.23
XLogP32.5
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count4
Exact Mass162.104465066
Monoisotopic Mass162.104465066
Topological Polar Surface Area20.2 Ų
Heavy Atom Count12
Formal Charge0
Complexity125
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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