Cinnamylideneacetic acid

CAT: 0931-T3006Size: 100 mgDry Ice: NoHazardous: No

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CAT#:0931-T3006Size:100 mg

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

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CAS Number

1552-94-9

Target

Antibacterial

Related Pathways

Microbiology/Virology

Purity

0.9975

Bioactivity

Cinnamylideneacetic acid (Beta-Styrylacrylic acid) is used as Synthetic building block, anti-malarial agent.

Smiles

C(=CC=CC(O)=O)C1=CC=CC=C1

Molecular Formula

C11H10O2

Molecular Weight

174.2

Shipping Conditions

Ice Packs

Storage Temperature

-20°C

Chemical Information

5-Phenyl-2,4-pentadienoic acid

CAS Number	1552-94-9
PubChem CID	73777
IUPAC Name	5-phenylpenta-2,4-dienoic acid
Molecular Formula	C11H10O2
Molecular Weight	174.20
XLogP	2.8
Topological Polar Surface Area	37.3
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	3
Heavy Atom Count	13
Formal Charge	0
Complexity	210

SMILES

C1=CC=C(C=C1)C=CC=CC(=O)O

InChI

InChI=1S/C11H10O2/c12-11(13)9-5-4-8-10-6-2-1-3-7-10/h1-9H,(H,12,13)

InChIKey

FEIQOMCWGDNMHM-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 1552-94-9

CID: 73777

Formula: C11H10O2

MW: 174.20

Interactive 3D Structure

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View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	174.20
XLogP3	2.8
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	3
Exact Mass	174.068079557
Monoisotopic Mass	174.068079557
Topological Polar Surface Area	37.3 Å²
Heavy Atom Count	13
Formal Charge	0
Complexity	210
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	2
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

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Catalog	Name
BUP17971	Cinnamylideneacetic acid
OR1071368-01	Acid-apeg6-acid
MBS6083807-01	Medronic Acid (Methylenebiphosphonic Acid, Methylenediphosphonic Acid, Methanebisphosphonic Acid, Methanediphosphonic Acid, MDP)
L2500-01	Lipoic Acid (Thioctic Acid, (±) -α-Lipoic Acid)
041005	Cacodylic Acid (dimethylarsonic acid, dimethylarsinic acid)
MBS641082-01	Lipoic Acid (Thioctic Acid, Alpha Lipoic Acid)
275335-01	Ethylenediaminediacetic acid dipropionic acid
O8099-01	Oxalacetic Acid (Oxaloacetic acid)
MBS6036559-01	a-Lipoic Acid (Thioctic Acid)
MBS651473-01	Ambuic acid ((+)-Ambuic acid)

Cinnamylideneacetic acid

Chemical Information

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