Name: Name:α-Cyano-4-methoxycinnamic acid
Brand: Angene
SKU: AG003NS1
Rating: 90 (10 reviews)

α-Cyano-4-methoxycinnamic acid

CAS No.:

1519-55-7

Catalog Number:

AG003NS1

Molecular Formula:

C11H9NO3

Molecular Weight:

203.1941

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Product Description

Catalog Number:

AG003NS1

Chemical Name:

α-Cyano-4-methoxycinnamic acid

CAS Number:

1519-55-7

Molecular Formula:

C11H9NO3

Molecular Weight:

203.1941

MDL Number:

MFCD00051722

IUPAC Name:

(E)-2-cyano-3-(4-methoxyphenyl)prop-2-enoic acid

InChI:

InChI=1S/C11H9NO3/c1-15-10-4-2-8(3-5-10)6-9(7-12)11(13)14/h2-6H,1H3,(H,13,14)/b9-6+

InChI Key:

KMHNRJDDHTZZDZ-RMKNXTFCSA-N

SMILES:

COc1ccc(cc1)/C=C(/C(=O)O)\C#N

NSC Number:

31629

Properties

Complexity:

305

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

203.058g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

203.197g/mol

Monoisotopic Mass:

203.058g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

70.3A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.8

Literature

Title	Journal
Tyrphostins I: synthesis and biological activity of protein tyrosine kinase inhibitors.	Journal of medicinal chemistry 19891001

Properties