Name: Name:2-(3-methoxyphenyl)-2-(morpholin-4-yl)acetonitrile
Brand: Angene
SKU: AG00IP1H
Rating: 90 (10 reviews)

2-(3-methoxyphenyl)-2-(morpholin-4-yl)acetonitrile

CAS No.:

123567-57-7

Catalog Number:

AG00IP1H

Molecular Formula:

C13H16N2O2

Molecular Weight:

232.2783

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Product Description

Catalog Number:

AG00IP1H

Chemical Name:

2-(3-methoxyphenyl)-2-(morpholin-4-yl)acetonitrile

CAS Number:

123567-57-7

Molecular Formula:

C13H16N2O2

Molecular Weight:

232.2783

MDL Number:

MFCD00172615

IUPAC Name:

2-(3-methoxyphenyl)-2-morpholin-4-ylacetonitrile

InChI:

InChI=1S/C13H16N2O2/c1-16-12-4-2-3-11(9-12)13(10-14)15-5-7-17-8-6-15/h2-4,9,13H,5-8H2,1H3

InChI Key:

FGYIFPNWPBUVLI-UHFFFAOYSA-N

SMILES:

N#CC(c1cccc(c1)OC)N1CCOCC1

Properties

Complexity:

280

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

232.121g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

232.283g/mol

Monoisotopic Mass:

232.121g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

45.5A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.3

Literature

Title	Journal
Microsphere-based protease assays and screening application for lethal factor and factor Xa.	Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501

Properties