Trans-1,3-Pentadiene

CAT: 0024-sc-258263Size: 1 gDry Ice: NoHazardous: No

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CAT#:0024-sc-258263Size:1 g

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CAS Number

2004-70-8

Chemical Information

1,3-Pentadiene

(E)-1,3-pentadiene is an alkadiene consisting of pentane with the two double bonds located at positions 1 and 3.

CAS Number	2004-70-8
PubChem CID	62204
IUPAC Name	(3E)-penta-1,3-diene
Molecular Formula	C5H8
Molecular Weight	68.12
XLogP	2.4
Topological Polar Surface Area	0
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	0
Rotatable Bond Count	1
Heavy Atom Count	5
Formal Charge	0
Complexity	42

SMILES

C/C=C/C=C

InChI

InChI=1S/C5H8/c1-3-5-4-2/h3-5H,1H2,2H3/b5-4+

InChIKey

PMJHHCWVYXUKFD-SNAWJCMRSA-N

Chemical Structure

2D Structure

CAS: 2004-70-8

CID: 62204

Formula: C5H8

MW: 68.12

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	68.12
XLogP3	2.4
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	0
Rotatable Bond Count	1
Exact Mass	68.062600255
Monoisotopic Mass	68.062600255
Topological Polar Surface Area	0 Å²
Heavy Atom Count	5
Formal Charge	0
Complexity	42
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	1
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
sc-256528	3-Methyl-1,3-pentadiene, mixture of cis and trans
sc-486270	Cis-1,3-Pentadiene
sc-485406	1,2-Pentadiene
sc-226132	3-Methyl-1,4-pentadiene
sc-223471A	2,4-Dimethyl-1,3-pentadiene
sc-223471	2,4-Dimethyl-1,3-pentadiene
sc-256185	2-Methyl-1,4-pentadiene
sc-486686	Trans, trans-1,5-Bis (4-fluorophenyl) -1,4-pentadien-3-one
sc-224989	(1E,3Z) -1-Methoxy-2-methyl-3- (trimethylsilyloxy) -1,3-pentadiene
sc-303294A	1-Chloro-1,2-difluoro-1,4-pentadiene

Catalog	Name
OR1078283-01	Trans-1,3-Pentadiene (stabilized with TBC)
FM158789-01	Trans-2-Methyl-1,3-pentadiene
M24250	Trans-2-Methyl-1,3-pentadiene 95% ampouled
OR1077662	1,3-Pentadiene (cis- and trans- mixture) (stabilized with TBC)
OR1101509	3-Methyl-1,3-Pentadiene
FP138597-01	(3E) -1,3-Pentadiene
OR1079009-01	1,4-Pentadiene
OR1078513-01	1,2-Pentadiene
FD184441-01	2,4-Dimethyl-1,3-pentadiene
OR1078433-01	Cis-1,3-Pentadiene (stabilized with TBC)