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Home > Other Heterocycles > 141316-87-2
141316-87-2 | 1,4-Dioxaspiro[4.5]decane-2,3-dimethanol, (2R,3S)-rel-
CAS No: 141316-87-2 Catalog No: AG001G7S MDL No:
Product Description
Catalog Number:
AG001G7S
Chemical Name:
1,4-Dioxaspiro[4.5]decane-2,3-dimethanol, (2R,3S)-rel-
CAS Number:
141316-87-2
Molecular Formula:
C10H18O4
Molecular Weight:
202.2475
IUPAC Name:
[3-(hydroxymethyl)-1,4-dioxaspiro[4.5]decan-2-yl]methanol
InChI:
InChI=1S/C10H18O4/c11-6-8-9(7-12)14-10(13-8)4-2-1-3-5-10/h8-9,11-12H,1-7H2
InChI Key:
ABVCJORPEQXLLH-UHFFFAOYSA-N
SMILES:
OC[C@@H]1OC2(O[C@@H]1CO)CCCCC2
Properties
Complexity:
175
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
202.121g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
202.25g/mol
Monoisotopic Mass:
202.121g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
58.9A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
0.2
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