Name: Name:5-Oxa-2-azaspiro[3.4]octane-2-carboxylic acid, 7-(hydroxymethyl)-, 1,1-dimethylethyl ester
Brand: Angene
SKU: AG001474
Rating: 90 (10 reviews)

5-Oxa-2-azaspiro[3.4]octane-2-carboxylic acid, 7-(hydroxymethyl)-, 1,1-dimethylethyl ester

CAS No.:

1330764-06-1

Catalog Number:

AG001474

Molecular Formula:

C12H21NO4

Molecular Weight:

243.2994

Catalog Number:

AG001474

Chemical Name:

5-Oxa-2-azaspiro[3.4]octane-2-carboxylic acid, 7-(hydroxymethyl)-, 1,1-dimethylethyl ester

CAS Number:

1330764-06-1

Molecular Formula:

C12H21NO4

Molecular Weight:

243.2994

MDL Number:

MFCD20230641

IUPAC Name:

tert-butyl 7-(hydroxymethyl)-5-oxa-2-azaspiro[3.4]octane-2-carboxylate

InChI:

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

InChI Key:

IKNCPKYWSVUNAN-UHFFFAOYSA-N

SMILES:

OCC1COC2(C1)CN(C2)C(=O)OC(C)(C)C

Complexity:

304

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:

59A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.3