Name: Name:6-Oxaspiro[4.5]decane-9-acetonitrile, 9-(2-pyridinyl)-, (9R)-
Brand: Angene
SKU: AG001C0G
Rating: 90 (10 reviews)

6-Oxaspiro[4.5]decane-9-acetonitrile, 9-(2-pyridinyl)-, (9R)-

CAS No.:

1401031-38-6

Catalog Number:

AG001C0G

Molecular Formula:

C16H20N2O

Molecular Weight:

256.3428

Catalog Number:

AG001C0G

Chemical Name:

6-Oxaspiro[4.5]decane-9-acetonitrile, 9-(2-pyridinyl)-, (9R)-

CAS Number:

1401031-38-6

Molecular Formula:

C16H20N2O

Molecular Weight:

256.3428

MDL Number:

MFCD28134617

IUPAC Name:

2-[(9R)-9-pyridin-2-yl-6-oxaspiro[4.5]decan-9-yl]acetonitrile

InChI:

InChI=1S/C16H20N2O/c17-10-8-15(14-5-1-4-11-18-14)9-12-19-16(13-15)6-2-3-7-16/h1,4-5,11H,2-3,6-9,12-13H2/t15-/m1/s1

InChI Key:

AJVYDBCIZBRGAK-OAHLLOKOSA-N

SMILES:

N#CC[C@]1(CCOC2(C1)CCCC2)c1ccccn1

Complexity:

366

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

256.158g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

256.349g/mol

Monoisotopic Mass:

256.158g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

45.9A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.1