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Home > Other Heterocycles > 919482-23-8
919482-23-8 | Spiro[3.5]nonan-1-one, 5-[(phenylmethoxy)methyl]-
CAS No: 919482-23-8 Catalog No: AG006IKN MDL No:
Product Description
Catalog Number:
AG006IKN
Chemical Name:
Spiro[3.5]nonan-1-one, 5-[(phenylmethoxy)methyl]-
CAS Number:
919482-23-8
Molecular Formula:
C17H22O2
Molecular Weight:
258.3554
IUPAC Name:
9-(phenylmethoxymethyl)spiro[3.5]nonan-3-one
InChI:
InChI=1S/C17H22O2/c18-16-9-11-17(16)10-5-4-8-15(17)13-19-12-14-6-2-1-3-7-14/h1-3,6-7,15H,4-5,8-13H2
InChI Key:
OYDSYOUQXFLVNP-UHFFFAOYSA-N
SMILES:
O=C1CCC21CCCCC2COCc1ccccc1
Properties
Complexity:
319
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
258.162g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
258.361g/mol
Monoisotopic Mass:
258.162g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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