Name: Name:tert-butyl 4-amino-5-(hydroxymethyl)azepane-1-carboxylate
Brand: Angene
SKU: AG01EMMS
Rating: 90 (10 reviews)

tert-butyl 4-amino-5-(hydroxymethyl)azepane-1-carboxylate

CAS No.:

1779867-29-6

Catalog Number:

AG01EMMS

Molecular Formula:

C12H24N2O3

Molecular Weight:

244.3306

Catalog Number:

AG01EMMS

Chemical Name:

tert-butyl 4-amino-5-(hydroxymethyl)azepane-1-carboxylate

CAS Number:

1779867-29-6

Molecular Formula:

C12H24N2O3

Molecular Weight:

244.3306

MDL Number:

MFCD28623362

IUPAC Name:

tert-butyl 4-amino-5-(hydroxymethyl)azepane-1-carboxylate

InChI:

InChI=1S/C12H24N2O3/c1-12(2,3)17-11(16)14-6-4-9(8-15)10(13)5-7-14/h9-10,15H,4-8,13H2,1-3H3

InChI Key:

YRWUPIZWWMQTQA-UHFFFAOYSA-N

SMILES:

OCC1CCN(CCC1N)C(=O)OC(C)(C)C

Complexity:

263

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

244.179g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

244.335g/mol

Monoisotopic Mass:

244.179g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

75.8A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.8