Name: Name:tert-butyl 6-amino-decahydroisoquinoline-2-carboxylate, Mixture of diastereomers
Brand: Angene
SKU: AG01EJ9D
Rating: 90 (10 reviews)

tert-butyl 6-amino-decahydroisoquinoline-2-carboxylate, Mixture of diastereomers

CAS No.:

1246033-04-4

Catalog Number:

AG01EJ9D

Molecular Formula:

C14H26N2O2

Molecular Weight:

254.3684

Catalog Number:

AG01EJ9D

Chemical Name:

tert-butyl 6-amino-decahydroisoquinoline-2-carboxylate, Mixture of diastereomers

CAS Number:

1246033-04-4

Molecular Formula:

C14H26N2O2

Molecular Weight:

254.3684

MDL Number:

MFCD11223655

IUPAC Name:

tert-butyl 6-amino-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinoline-2-carboxylate

InChI:

InChI=1S/C14H26N2O2/c1-14(2,3)18-13(17)16-7-6-10-8-12(15)5-4-11(10)9-16/h10-12H,4-9,15H2,1-3H3

InChI Key:

ZJOCZWZSGVQGDF-UHFFFAOYSA-N

SMILES:

NC1CCC2C(C1)CCN(C2)C(=O)OC(C)(C)C

Complexity:

311

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

254.199g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

254.374g/mol

Monoisotopic Mass:

254.199g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

55.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.7