Name: Name:3-phenylpent-4-enoic acid
Brand: Angene
SKU: AG01A320
Rating: 90 (10 reviews)

3-phenylpent-4-enoic acid

CAS No.:

5703-57-1

Catalog Number:

AG01A320

Molecular Formula:

C11H12O2

Molecular Weight:

176.2118

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Product Description

Catalog Number:

AG01A320

Chemical Name:

3-phenylpent-4-enoic acid

CAS Number:

5703-57-1

Molecular Formula:

C11H12O2

Molecular Weight:

176.2118

MDL Number:

MFCD20638263

IUPAC Name:

3-phenylpent-4-enoic acid

InChI:

InChI=1S/C11H12O2/c1-2-9(8-11(12)13)10-6-4-3-5-7-10/h2-7,9H,1,8H2,(H,12,13)

InChI Key:

QENLDXDXWGMLMN-UHFFFAOYSA-N

SMILES:

C=CC(c1ccccc1)CC(=O)O

Properties

Complexity:

181

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

176.084g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

176.215g/mol

Monoisotopic Mass:

176.084g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

37.3A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.5

Literature

Title	Journal
A superior P-H phosphonite: asymmetric allylic substitutions with fenchol-based palladium catalysts.	Beilstein journal of organic chemistry 20060101