1,11-Dodecadiene

CAT: 0127-OR1020897Size: 1 EachDry Ice: NoHazardous: No

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CAT#:0127-OR1020897Size:1 Each

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CAS Number

5876-87-9

Purity

=95%

Smiles

C=CCCCCCCCCC=C

Chemical Information

1,11-Dodecadiene

1,11-Dodecadiene has been reported in Oryza sativa with data available.

CAS Number	5876-87-9
PubChem CID	22170
IUPAC Name	dodeca-1,11-diene
Molecular Formula	C12H22
Molecular Weight	166.30
XLogP	6.3
Topological Polar Surface Area	0
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	0
Rotatable Bond Count	9
Heavy Atom Count	12
Formal Charge	0
Complexity	88

SMILES

C=CCCCCCCCCC=C

InChI

InChI=1S/C12H22/c1-3-5-7-9-11-12-10-8-6-4-2/h3-4H,1-2,5-12H2

InChIKey

IYPLTVKTLDQUGG-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 5876-87-9

CID: 22170

Formula: C12H22

MW: 166.30

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	166.30
XLogP3	6.3
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	0
Rotatable Bond Count	9
Exact Mass	166.172150702
Monoisotopic Mass	166.172150702
Topological Polar Surface Area	0 Å²
Heavy Atom Count	12
Formal Charge	0
Complexity	88.6
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

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OR52369-01	11-Bromo-1-undecene
OR1052278-01	11-Azido-1-undecanol

Catalog	Name
TRC-D525738-100MG	1,11-Dodecadiene
421506-01	(2E,6E,10S) -3,7,11-Trimethyl-2,6-dodecadiene-1,10,11-triol 1-Acetate
464971-01	[S-[R, R- (E) ]]-3,7,11-Trimethyl-2,10-dodecadiene-1,6,7-triol 1-Acetate
A601648	[S-[R,R-(E)]]-3,7,11-Trimethyl-2,10-dodecadiene-1,6,7-triol 1-Acetate
410435-01	1,1,1,11,11,11-hexachloroundecane discontinued
410461-01	1,1,11,11-Tetrachloroundecane
B688439	1-Bromoundecane-11,11,11-d3
TRC-D361920-50MG	11-Desethyl 11-(1-Hydroxypropyl) Irinotecan
HY-W110322	1,11-Diaminoundecane
UYB00849-01	Mal (11.1)