Name: Name:(4aR,8aR)-6-tert-butyl 4a-ethyl hexahydro-2H-pyrano[3,2-c]pyridine-4a,6(7H)-dicarboxylate
Brand: Angene
SKU: AG01DJRH
Rating: 90 (10 reviews)

(4aR,8aR)-6-tert-butyl 4a-ethyl hexahydro-2H-pyrano[3,2-c]pyridine-4a,6(7H)-dicarboxylate

CAS No.:

1445951-17-6

Catalog Number:

AG01DJRH

Molecular Formula:

C16H27NO5

Molecular Weight:

313.3893

Catalog Number:

AG01DJRH

Chemical Name:

(4aR,8aR)-6-tert-butyl 4a-ethyl hexahydro-2H-pyrano[3,2-c]pyridine-4a,6(7H)-dicarboxylate

CAS Number:

1445951-17-6

Molecular Formula:

C16H27NO5

Molecular Weight:

313.3893

MDL Number:

MFCD31803383

IUPAC Name:

6-O-tert-butyl 4a-O-ethyl (4aR,8aR)-3,4,5,7,8,8a-hexahydro-2H-pyrano[3,2-c]pyridine-4a,6-dicarboxylate

InChI:

InChI=1S/C16H27NO5/c1-5-20-13(18)16-8-6-10-21-12(16)7-9-17(11-16)14(19)22-15(2,3)4/h12H,5-11H2,1-4H3/t12-,16-/m1/s1

InChI Key:

RXTGYXNCCCTUAE-MLGOLLRUSA-N

SMILES:

CCOC(=O)[C@]12CCCO[C@@H]2CCN(C1)C(=O)OC(C)(C)C

Complexity:

431

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

313.189g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

313.394g/mol

Monoisotopic Mass:

313.189g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

65.1A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.7