Name: Name:4-Hydroxy-3-methoxyphenylacetonitrile
Brand: Angene
SKU: AG003LI0
Rating: 90 (10 reviews)

4-Hydroxy-3-methoxyphenylacetonitrile

CAS No.:

4468-59-1

Catalog Number:

AG003LI0

Molecular Formula:

C9H9NO2

Molecular Weight:

163.1733

Pack Size

Purity

Availability

Location

Price(USD)

Quantity

98%

In Stock USA

United States

$201

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Product Description

Catalog Number:

AG003LI0

Chemical Name:

4-Hydroxy-3-methoxyphenylacetonitrile

CAS Number:

4468-59-1

Molecular Formula:

C9H9NO2

Molecular Weight:

163.1733

MDL Number:

MFCD00001920

IUPAC Name:

2-(4-hydroxy-3-methoxyphenyl)acetonitrile

InChI:

InChI=1S/C9H9NO2/c1-12-9-6-7(4-5-10)2-3-8(9)11/h2-3,6,11H,4H2,1H3

InChI Key:

SDVYWMWQCJEYTC-UHFFFAOYSA-N

SMILES:

N#CCc1ccc(c(c1)OC)O

EC Number:

224-739-5

Properties

Complexity:

184

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

163.063g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

163.176g/mol

Monoisotopic Mass:

163.063g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

53.2A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.5

Literature

Title	Journal
Novel phenolic glycosides, adenophorasides A-E, from Adenophora roots.	Journal of natural medicines 20100701

Properties