Name: Name:tert-butyl 4-oxo-5-phenylazepane-1-carboxylate
Brand: Angene
SKU: AG01AFEX
Rating: 90 (10 reviews)

tert-butyl 4-oxo-5-phenylazepane-1-carboxylate

CAS No.:

1803562-89-1

Catalog Number:

AG01AFEX

Molecular Formula:

C17H23NO3

Molecular Weight:

289.3694

Catalog Number:

AG01AFEX

Chemical Name:

tert-butyl 4-oxo-5-phenylazepane-1-carboxylate

CAS Number:

1803562-89-1

Molecular Formula:

C17H23NO3

Molecular Weight:

289.3694

MDL Number:

MFCD22394850

IUPAC Name:

tert-butyl 4-oxo-5-phenylazepane-1-carboxylate

InChI:

InChI=1S/C17H23NO3/c1-17(2,3)21-16(20)18-11-9-14(15(19)10-12-18)13-7-5-4-6-8-13/h4-8,14H,9-12H2,1-3H3

InChI Key:

BYKSIHZVMLLOEO-UHFFFAOYSA-N

SMILES:

O=C1CCN(CCC1c1ccccc1)C(=O)OC(C)(C)C

Complexity:

380

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

289.168g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

289.375g/mol

Monoisotopic Mass:

289.168g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

46.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.6