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Home > Other Heterocycles > 4792-37-4
4792-37-4 | 1,4-dioxaspiro[4.6]undecan-8-one
CAS No: 4792-37-4 Catalog No: AG01B6EG MDL No:MFCD24688663
Product Description
Catalog Number:
AG01B6EG
Chemical Name:
1,4-dioxaspiro[4.6]undecan-8-one
CAS Number:
4792-37-4
Molecular Formula:
C9H14O3
Molecular Weight:
170.2057
MDL Number:
MFCD24688663
IUPAC Name:
1,4-dioxaspiro[4.6]undecan-8-one
InChI:
InChI=1S/C9H14O3/c10-8-2-1-4-9(5-3-8)11-6-7-12-9/h1-7H2
InChI Key:
IZELAGGXOUSOTJ-UHFFFAOYSA-N
SMILES:
O=C1CCCC2(CC1)OCCO2
Properties
Complexity:
182
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
170.094g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
170.208g/mol
Monoisotopic Mass:
170.094g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.2
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