2-Methyl-2-pentenal

CAT: 0024-sc-230507Size: 25 gDry Ice: NoHazardous: No

1 / 1

CAT#:0024-sc-230507Size:25 g

Selected

24/48H Stock Items & 2 to 6 Weeks non Stock Items.

Quick Request Actions

CAS Number

623-36-9

Chemical Information

2-Methyl-2-pentenal

2-Methyl-2-pentenal has been reported in Zea mays, Opuntia ficus-indica, and other organisms with data available.

CAS Number	623-36-9
PubChem CID	12177
IUPAC Name	2-methylpent-2-enal
Molecular Formula	C6H10O
Molecular Weight	98.14
XLogP	1.4
Topological Polar Surface Area	17.1
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	2
Heavy Atom Count	7
Formal Charge	0
Complexity	82

SMILES

CCC=C(C)C=O

InChI

InChI=1S/C6H10O/c1-3-4-6(2)5-7/h4-5H,3H2,1-2H3

InChIKey

IDEYZABHVQLHAF-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 623-36-9

CID: 12177

Formula: C6H10O

MW: 98.14

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	98.14
XLogP3	1.4
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	2
Exact Mass	98.073164938
Monoisotopic Mass	98.073164938
Topological Polar Surface Area	17.1 Å²
Heavy Atom Count	7
Formal Charge	0
Complexity	82.2
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	1
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
OR1010540-01	2-Methyl-2-Pentenal
283069-01	4-Methyl-2-pentenal
RG-E141596-01	2-Methyl-3-pentenal
OR1025123-01	4-Methyl-2-Phenyl-2-Pentenal
447861-01	(E) -2-Pentenal
FP76481	Trans-2-Pentenal
TRC-P270005-5G	(E)-2-Pentenal
OR1009940-01	2,2-Dimethyl-4-Pentenal
TRC-M220353-500MG	(E)-4-Methyl-2-phenyl-2-pentenal (Stabilized with a-tocopherol)
420343-01	2,4,4-Trimethyl-2-pentenal