Name: Name:tert-butyl 3a-(aminomethyl)-octahydro-1H-indole-1-carboxylate
Brand: Angene
SKU: AG01EJQV
Rating: 90 (10 reviews)

tert-butyl 3a-(aminomethyl)-octahydro-1H-indole-1-carboxylate

CAS No.:

2138231-04-4

Catalog Number:

AG01EJQV

Molecular Formula:

C14H26N2O2

Molecular Weight:

254.3684

Catalog Number:

AG01EJQV

Chemical Name:

tert-butyl 3a-(aminomethyl)-octahydro-1H-indole-1-carboxylate

CAS Number:

2138231-04-4

Molecular Formula:

C14H26N2O2

Molecular Weight:

254.3684

MDL Number:

MFCD31689394

IUPAC Name:

tert-butyl 3a-(aminomethyl)-3,4,5,6,7,7a-hexahydro-2H-indole-1-carboxylate

InChI:

InChI=1S/C14H26N2O2/c1-13(2,3)18-12(17)16-9-8-14(10-15)7-5-4-6-11(14)16/h11H,4-10,15H2,1-3H3

InChI Key:

APOAUNNOAJYODG-UHFFFAOYSA-N

SMILES:

NCC12CCCCC2N(CC1)C(=O)OC(C)(C)C

Complexity:

324

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:

1.9