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Citronellol

CAT: 1596-AR-C05288-02Size: 100 UnitsDry Ice: NoHazardous: No
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CAT#:1596-AR-C05288-02Size:100 Units
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CAS Number
106-22-9
Synonyms
6-Octen-1-ol, 3,7-dimethyl-, 3,7-Dimethyl-6-octen-1-ol, (±) -3,7-Dimethyl-6-octen-1-ol, (±) -Citronellol, (±) -ß-Citronellol
Molecular Formula
C10H20O
Molecular Weight
156.27
API Name
Citronellol

Chemical Information

Citronellol

Citronellol is a monoterpenoid that is oct-6-ene substituted by a hydroxy group at position 1 and methyl groups at positions 3 and 7. It has a role as a plant metabolite.

CAS Number106-22-9
PubChem CID8842
IUPAC Name3,7-dimethyloct-6-en-1-ol
Molecular FormulaC10H20O
Molecular Weight156.26
XLogP3.2
Topological Polar Surface Area20.2
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count5
Heavy Atom Count11
Formal Charge0
Complexity112
SMILES
CC(CCC=C(C)C)CCO
InChI
InChI=1S/C10H20O/c1-9(2)5-4-6-10(3)7-8-11/h5,10-11H,4,6-8H2,1-3H3
InChIKey
QMVPMAAFGQKVCJ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Citronellol
CAS: 106-22-9
CID: 8842
Formula: C10H20O
MW: 156.26
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight156.26
XLogP33.2
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count5
Exact Mass156.151415257
Monoisotopic Mass156.151415257
Topological Polar Surface Area20.2 Ų
Heavy Atom Count11
Formal Charge0
Complexity112
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Related Products

CatalogName
AR-T04543-01Citronellyl Propionate

Alternative Products

CatalogName
FC175239-01Citronellol
RM-C201209-01β-Citronellol
sc-294094(±) -β-Citronellol
FD157131-01(R) - (+) -β-Citronellol
HY-W010201R-01Citronellol (Standard)
464364-01Rac-Citronellol
MBS3611399-01(R)-Citronellol
A22280-1000Citronellol 1g
C23190-01B-Citronellol
XC182724-01Citronellol glucoside

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