Name: Name:2-TERT-BUTYL 8-ETHYL 6-THIA-2-AZASPIRO[3.4]OCTANE-2,8-DICARBOXYLATE
Brand: Angene
SKU: AG01DL8E
Rating: 90 (10 reviews)

2-TERT-BUTYL 8-ETHYL 6-THIA-2-AZASPIRO[3.4]OCTANE-2,8-DICARBOXYLATE

CAS No.:

1453316-13-6

Catalog Number:

AG01DL8E

Molecular Formula:

C14H23NO4S

Molecular Weight:

301.4017

Catalog Number:

AG01DL8E

Chemical Name:

2-TERT-BUTYL 8-ETHYL 6-THIA-2-AZASPIRO[3.4]OCTANE-2,8-DICARBOXYLATE

CAS Number:

1453316-13-6

Molecular Formula:

C14H23NO4S

Molecular Weight:

301.4017

MDL Number:

MFCD27996134

IUPAC Name:

2-O-tert-butyl 8-O-ethyl 6-thia-2-azaspiro[3.4]octane-2,8-dicarboxylate

InChI:

InChI=1S/C14H23NO4S/c1-5-18-11(16)10-6-20-9-14(10)7-15(8-14)12(17)19-13(2,3)4/h10H,5-9H2,1-4H3

InChI Key:

WURUNYUYWWOXJZ-UHFFFAOYSA-N

SMILES:

CCOC(=O)C1CSCC21CN(C2)C(=O)OC(C)(C)C

Complexity:

399

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

301.135g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

301.401g/mol

Monoisotopic Mass:

301.135g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

81.1A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.6