Name: Name:1-(ethoxycarbonyl)spiro[2.3]hexane-5-carboxylic acid, Mixture of diastereomers
Brand: Angene
SKU: AG01EKN0
Rating: 90 (10 reviews)

1-(ethoxycarbonyl)spiro[2.3]hexane-5-carboxylic acid, Mixture of diastereomers

CAS No.:

2138521-86-3

Catalog Number:

AG01EKN0

Molecular Formula:

C10H14O4

Molecular Weight:

198.2158

Catalog Number:

AG01EKN0

Chemical Name:

1-(ethoxycarbonyl)spiro[2.3]hexane-5-carboxylic acid, Mixture of diastereomers

CAS Number:

2138521-86-3

Molecular Formula:

C10H14O4

Molecular Weight:

198.2158

MDL Number:

MFCD31559435

IUPAC Name:

2-ethoxycarbonylspiro[2.3]hexane-5-carboxylic acid

InChI:

InChI=1S/C10H14O4/c1-2-14-9(13)7-5-10(7)3-6(4-10)8(11)12/h6-7H,2-5H2,1H3,(H,11,12)

InChI Key:

AKHUJHGPWNAGMI-UHFFFAOYSA-N

SMILES:

CCOC(=O)C1CC21CC(C2)C(=O)O

Complexity:

278

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

198.089g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

198.218g/mol

Monoisotopic Mass:

198.089g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

63.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.7