(+) -Perillaldehyde

CAT: 0931-TN6812-01Size: 1 mgDry Ice: NoHazardous: No

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CAT#:0931-TN6812-01Size:1 mg

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CAS Number

5503-12-8

Bioactivity

(+) -Perillaldehyde is a natural product.

Smiles

C(C)(=C)[C@@H]1CCC(C=O)=CC1

Molecular Formula

C10H14O

Molecular Weight

150.22

Shipping Conditions

Ice Packs

Storage Temperature

-20°C

Chemical Information

Perillaldehyde, (+)-

(+)-perillaldehyde has been reported in Perilla frutescens, Coleus scutellarioides, and other organisms with data available.

CAS Number	5503-12-8
PubChem CID	1548901
IUPAC Name	(4R)-4-prop-1-en-2-ylcyclohexene-1-carbaldehyde
Molecular Formula	C10H14O
Molecular Weight	150.22
XLogP	2.6
Topological Polar Surface Area	17.1
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	2
Heavy Atom Count	11
Formal Charge	0
Complexity	201

SMILES

CC(=C)[C@@H]1CCC(=CC1)C=O

InChI

InChI=1S/C10H14O/c1-8(2)10-5-3-9(7-11)4-6-10/h3,7,10H,1,4-6H2,2H3/t10-/m0/s1

InChIKey

RUMOYJJNUMEFDD-JTQLQIEISA-N

Chemical Structure

2D Structure

CAS: 5503-12-8

CID: 1548901

Formula: C10H14O

MW: 150.22

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	150.22
XLogP3	2.6
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	2
Exact Mass	150.104465066
Monoisotopic Mass	150.104465066
Topological Polar Surface Area	17.1 Å²
Heavy Atom Count	11
Formal Charge	0
Complexity	201
Isotope Atom Count	0
Defined Atom Stereocenter Count	1
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
TRC-P229700-5G	(±)-Perillaldehyde
TBZ2757	(-)-Perillaldehyde
GTR19221862-01	(+) -Perillaldehyde
BUP16018	(-) -Perillaldehyde
S3205-25mg	Perillaldehyde
HY-W753791-01	(±) -Perillaldehyde
FP61740-01	(+/-) -Perillaldehyde
MBS5788815	(+)-Perillaldehyde
HY-N9840-01	(R) -Perillaldehyde
288469-01	(-) -Perillaldehyde discontinued