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Home > Other Heterocycles > 1517862-80-4
1517862-80-4 | 1,9-dioxaspiro[5.5]undecan-4-ylmethanol
CAS No: 1517862-80-4 Catalog No: AG01DVI5 MDL No:MFCD23793292
Product Description
Catalog Number:
AG01DVI5
Chemical Name:
1,9-dioxaspiro[5.5]undecan-4-ylmethanol
CAS Number:
1517862-80-4
Molecular Formula:
C10H18O3
Molecular Weight:
186.2481
MDL Number:
MFCD23793292
IUPAC Name:
1,9-dioxaspiro[5.5]undecan-4-ylmethanol
InChI:
InChI=1S/C10H18O3/c11-8-9-1-4-13-10(7-9)2-5-12-6-3-10/h9,11H,1-8H2
InChI Key:
FMIITHDTPFFAGS-UHFFFAOYSA-N
SMILES:
OCC1CCOC2(C1)CCOCC2
Properties
Complexity:
164
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
186.126g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
186.251g/mol
Monoisotopic Mass:
186.126g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
38.7A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4
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