Name: Name:tert-butyl 3a-aminooctahydro-1H-indole-1-carboxylate
Brand: Angene
SKU: AG01C73Z
Rating: 90 (10 reviews)

tert-butyl 3a-aminooctahydro-1H-indole-1-carboxylate

CAS No.:

1251013-69-0

Catalog Number:

AG01C73Z

Molecular Formula:

C13H24N2O2

Molecular Weight:

240.3419

Catalog Number:

AG01C73Z

Chemical Name:

tert-butyl 3a-aminooctahydro-1H-indole-1-carboxylate

CAS Number:

1251013-69-0

Molecular Formula:

C13H24N2O2

Molecular Weight:

240.3419

MDL Number:

MFCD17016468

IUPAC Name:

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

InChI:

InChI=1S/C13H24N2O2/c1-12(2,3)17-11(16)15-9-8-13(14)7-5-4-6-10(13)15/h10H,4-9,14H2,1-3H3

InChI Key:

ZIRHPMBSDWIIGA-UHFFFAOYSA-N

SMILES:

O=C(N1CCC2(C1CCCC2)N)OC(C)(C)C

Complexity:

311

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

240.184g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

240.347g/mol

Monoisotopic Mass:

240.184g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

55.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.5