Name: Name:tert-butyl 2-(3-hydroxy-2-oxoazepan-1-yl)acetate
Brand: Angene
SKU: AG01BRUM
Rating: 90 (10 reviews)

tert-butyl 2-(3-hydroxy-2-oxoazepan-1-yl)acetate

CAS No.:

2060042-67-1

Catalog Number:

AG01BRUM

Molecular Formula:

C12H21NO4

Molecular Weight:

243.2994

Catalog Number:

AG01BRUM

Chemical Name:

tert-butyl 2-(3-hydroxy-2-oxoazepan-1-yl)acetate

CAS Number:

2060042-67-1

Molecular Formula:

C12H21NO4

Molecular Weight:

243.2994

MDL Number:

MFCD30535902

IUPAC Name:

tert-butyl 2-(3-hydroxy-2-oxoazepan-1-yl)acetate

InChI:

InChI=1S/C12H21NO4/c1-12(2,3)17-10(15)8-13-7-5-4-6-9(14)11(13)16/h9,14H,4-8H2,1-3H3

InChI Key:

XMZBNDPTJNSBBU-UHFFFAOYSA-N

SMILES:

O=C(OC(C)(C)C)CN1CCCCC(C1=O)O

Complexity:

295

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

243.147g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

243.303g/mol

Monoisotopic Mass:

243.147g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

66.8A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.9