Name: Name:1-Oxaspiro[2.5]octane-2-carboxylicacid,methylester(7CI,8CI,9CI)
Brand: Angene
SKU: AG00D1FT
Rating: 90 (10 reviews)

1-Oxaspiro[2.5]octane-2-carboxylicacid,methylester(7CI,8CI,9CI)

CAS No.:

33717-87-2

Catalog Number:

AG00D1FT

Molecular Formula:

C9H14O3

Molecular Weight:

170.2057

Catalog Number:

AG00D1FT

Chemical Name:

1-Oxaspiro[2.5]octane-2-carboxylicacid,methylester(7CI,8CI,9CI)

CAS Number:

33717-87-2

Molecular Formula:

C9H14O3

Molecular Weight:

170.2057

MDL Number:

MFCD01605703

IUPAC Name:

methyl 1-oxaspiro[2.5]octane-2-carboxylate

InChI:

InChI=1S/C9H14O3/c1-11-8(10)7-9(12-7)5-3-2-4-6-9/h7H,2-6H2,1H3

InChI Key:

NJSZVKRLALSUAD-UHFFFAOYSA-N

SMILES:

COC(=O)C1OC21CCCCC2

NSC Number:

195104

Complexity:

194

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

170.094g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

170.208g/mol

Monoisotopic Mass:

170.094g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

38.8A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.4