[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]methanol

C11H20O5 — CID 10944310

IUPAC[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]methanol
SMILESCC1(C)OC[C@@H](C(O)[C@H]2COC(C)(C)O2)O1
InChIInChI=1S/C11H20O5/c1-10(2)13-5-7(15-10)9(12)8-6-14-11(3,4)16-8/h7-9,12H,5-6H2,1-4H3/t7-,8+,9?
InChIKeyNQJMKBQMFSCMFO-JVHMLUBASA-N
MW232.28 g/mol
LogP0.65
Rot. Bonds2

About [(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]methanol

[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]methanol (PubChem CID 10944310) has the molecular formula C11H20O5 and a molecular weight of 232.28 g/mol. Its IUPAC name is [(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]methanol.

Molecular Properties

Compound Name[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]methanol
PubChem CID10944310
Molecular FormulaC11H20O5
Molecular Weight232.28 g/mol
Exact Mass232.13
IUPAC Name[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]methanol
SMILESCC1(C)OC[C@@H](C(O)[C@H]2COC(C)(C)O2)O1
InChIInChI=1S/C11H20O5/c1-10(2)13-5-7(15-10)9(12)8-6-14-11(3,4)16-8/h7-9,12H,5-6H2,1-4H3/t7-,8+,9?
InChIKeyNQJMKBQMFSCMFO-JVHMLUBASA-N
XLogP0.65
TPSA57.15 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.28
LogP ≤ 50.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze [(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]methanol with MolForge

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Related Compounds

beta-D-Fructofuranoside, ethyl
CID 11769694
1,2-O-isopropylidene-alpha-D-xylofuranose
CID 88338
Glucofuranose, 1,2-O-isopropylidene-, alpha-D-
CID 219905
beta-D-Fructofuranoside, methyl
CID 128889
alpha-D-Fructofuranoside, methyl
CID 6325664
alpha-D-Arabinofuranoside, methyl
CID 11389582
beta-D-Ribofuranoside, methyl
CID 255320
alpha-D-Xylofuranoside, methyl
CID 11147907
alpha-D-Ribofuranoside, methyl
CID 12889245
1,2-O-Isopropylidene-alpha-D-glucofuranose
CID 87704
beta-D-fructofuranosyl-(2,1)-beta-D-fructofuranose
CID 439552
Butyl fructofuranoside
CID 13386213

Frequently Asked Questions

What is the IUPAC name of [(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]methanol?
The IUPAC name of [(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]methanol (CID 10944310) is [(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]methanol.
What is the SMILES notation for [(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]methanol?
The canonical SMILES for [(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]methanol is CC1(C)OC[C@@H](C(O)[C@H]2COC(C)(C)O2)O1.
What is the InChIKey of [(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]methanol?
The InChIKey is NQJMKBQMFSCMFO-JVHMLUBASA-N. The full InChI is InChI=1S/C11H20O5/c1-10(2)13-5-7(15-10)9(12)8-6-14-11(3,4)16-8/h7-9,12H,5-6H2,1-4H3/t7-,8+,9?.
What are the key properties of [(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]methanol?
[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]methanol has a molecular weight of 232.28 g/mol, XLogP of 0.65, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]methanol is sourced from PubChem (CID 10944310), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).