Name: Name:2-methyl-2-{1,4,7-trioxaspiro[4.4]nonan-9-yl}propanenitrile
Brand: Angene
SKU: AG01C1G3
Rating: 90 (10 reviews)

2-methyl-2-{1,4,7-trioxaspiro[4.4]nonan-9-yl}propanenitrile

CAS No.:

1909327-19-0

Catalog Number:

AG01C1G3

Molecular Formula:

C10H15NO3

Molecular Weight:

197.2310

Catalog Number:

AG01C1G3

Chemical Name:

2-methyl-2-{1,4,7-trioxaspiro[4.4]nonan-9-yl}propanenitrile

CAS Number:

1909327-19-0

Molecular Formula:

C10H15NO3

Molecular Weight:

197.2310

MDL Number:

MFCD29047283

IUPAC Name:

2-methyl-2-(1,4,7-trioxaspiro[4.4]nonan-9-yl)propanenitrile

InChI:

InChI=1S/C10H15NO3/c1-9(2,6-11)8-5-12-7-10(8)13-3-4-14-10/h8H,3-5,7H2,1-2H3

InChI Key:

OKGQZCNOTOUBQV-UHFFFAOYSA-N

SMILES:

N#CC(C1COCC21OCCO2)(C)C

Complexity:

272

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

197.105g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

197.234g/mol

Monoisotopic Mass:

197.105g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

51.5A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.2