Cinnamic acid

CAT: 1299-RG-C091402-02Size: 25 mgDry Ice: NoHazardous: No

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CAT#:1299-RG-C091402-02Size:25 mg

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CAS Number

140-10-3

Synonyms

Cinnamic acid

Molecular Formula

C9H8O2

Molecular Weight

148.16

Product Name Synonym

Cinnamic acid

Chemical Information

Cinnamic Acid

Cinnamic acid is a monocarboxylic acid that consists of acrylic acid bearing a phenyl substituent at the 3-position. It is found in Cinnamomum cassia. It has a role as a plant metabolite. It is a member of cinnamic acids and a member of styrenes. It is a conjugate acid of a cinnamate.

CAS Number	140-10-3
PubChem CID	444539
IUPAC Name	(E)-3-phenylprop-2-enoic acid
Molecular Formula	C9H8O2
Molecular Weight	148.16
XLogP	2.1
Topological Polar Surface Area	37.3
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	2
Heavy Atom Count	11
Formal Charge	0
Complexity	155

SMILES

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

InChI

InChI=1S/C9H8O2/c10-9(11)7-6-8-4-2-1-3-5-8/h1-7H,(H,10,11)/b7-6+

InChIKey

WBYWAXJHAXSJNI-VOTSOKGWSA-N

Chemical Structure

2D Structure

CAS: 140-10-3

CID: 444539

Formula: C9H8O2

MW: 148.16

Interactive 3D Structure

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View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	148.16
XLogP3	2.1
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	2
Exact Mass	148.052429494
Monoisotopic Mass	148.052429494
Topological Polar Surface Area	37.3 Å²
Heavy Atom Count	11
Formal Charge	0
Complexity	155
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

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Alternative Products

Catalog	Name
A9923-200	Cinnamic acid

Cinnamic acid

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