Name: Name:tert-butyl 9-hydroxy-2-oxa-5-azabicyclo[4.2.1]nonane-5-carboxylate
Brand: Angene
SKU: AG01DHFR
Rating: 90 (10 reviews)

tert-butyl 9-hydroxy-2-oxa-5-azabicyclo[4.2.1]nonane-5-carboxylate

CAS No.:

1422343-87-0

Catalog Number:

AG01DHFR

Molecular Formula:

C12H21NO4

Molecular Weight:

243.2994

Catalog Number:

AG01DHFR

Chemical Name:

tert-butyl 9-hydroxy-2-oxa-5-azabicyclo[4.2.1]nonane-5-carboxylate

CAS Number:

1422343-87-0

Molecular Formula:

C12H21NO4

Molecular Weight:

243.2994

MDL Number:

MFCD31652271

IUPAC Name:

tert-butyl 9-hydroxy-2-oxa-5-azabicyclo[4.2.1]nonane-5-carboxylate

InChI:

InChI=1S/C12H21NO4/c1-12(2,3)17-11(15)13-6-7-16-9-5-4-8(13)10(9)14/h8-10,14H,4-7H2,1-3H3

InChI Key:

ORRRMIVPONXXNG-UHFFFAOYSA-N

SMILES:

OC1C2OCCN(C1CC2)C(=O)OC(C)(C)C

Complexity:

299

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

243.147g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

243.303g/mol

Monoisotopic Mass:

243.147g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

59A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.7