Name: Name:1-Oxa-7-azaspiro[3.5]nonane-7-carboxylic acid, 2-(iodoMethyl)-, 1,1-diMethylethyl ester
Brand: Angene
SKU: AG0099I4
Rating: 90 (10 reviews)

1-Oxa-7-azaspiro[3.5]nonane-7-carboxylic acid, 2-(iodoMethyl)-, 1,1-diMethylethyl ester

CAS No.:

1160246-84-3

Catalog Number:

AG0099I4

Molecular Formula:

C13H22INO3

Molecular Weight:

367.2231

Catalog Number:

AG0099I4

Chemical Name:

1-Oxa-7-azaspiro[3.5]nonane-7-carboxylic acid, 2-(iodoMethyl)-, 1,1-diMethylethyl ester

CAS Number:

1160246-84-3

Molecular Formula:

C13H22INO3

Molecular Weight:

367.2231

MDL Number:

MFCD12198522

IUPAC Name:

tert-butyl 2-(iodomethyl)-1-oxa-7-azaspiro[3.5]nonane-7-carboxylate

InChI:

InChI=1S/C13H22INO3/c1-12(2,3)18-11(16)15-6-4-13(5-7-15)8-10(9-14)17-13/h10H,4-9H2,1-3H3

InChI Key:

BYWOAGRBPWRFSD-UHFFFAOYSA-N

SMILES:

ICC1CC2(O1)CCN(CC2)C(=O)OC(C)(C)C

Complexity:

319

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

367.064g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

367.227g/mol

Monoisotopic Mass:

367.064g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

38.8A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.6