(-)alpha-DioxolanT

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Basic information

CAS: 145414-66-0
Standard SMILES: Cc1cn([C@H]2CO[C@H](CO)O2)c(=O)[nH]c1=O
InChIKey: BCAWWPAPHSAUQZ-RQJHMYQMSA-N
Molecular formula: C9H12N2O5
Average molar mass: 228.2 g/mol
Monoisotopic mass: 228.07462149

Names & identifiers

Preferred name: (-)alpha-DioxolanT
IUPAC: 1-[(2S,4R)-2-(hydroxymethyl)-1,3-dioxolan-4-yl]-5-methylpyrimidine-2,4-dione

Names & synonyms

(-)alpha-DioxolanT145414-66-0(-)-(2S,4R)-1-(2-(Hydroxymethyl)-1,3-dioxolan-4-yl)thymine2,4(1H,3H)-Pyrimidinedione, 1-(2-(hydroxymethyl)-1,3-dioxolan-4-yl)-5-methyl-, (2S-trans)-(-)-(2S,4R)-1-[2-(Hydroxymethyl)-1,3-dioxolan-4-yl]thymine2,4(1H,3H)-Pyrimidinedione, 1-[2-(hydroxymethyl)-1,3-dioxolan-4-yl]-5-methyl-, (2S-trans)-(-).alpha.-DioxolanTCHEMBL146798SCHEMBL6314490DTXSID401630072,4(1H,3H)-Pyrimidinedione,1-[2-(hydroxymethyl)-1,3-dioxolan-4-yl]-5-methyl-, (2S-trans)- (9CI)1-[(2S,4R)-2-(hydroxymethyl)-1,3-dioxolan-4-yl]-5-methyl-pyrimidine-2,4-dione

Show more names

1-[(2S,4R)-2-(Hydroxymethyl)-1,3-dioxolan-4-yl]-5-methylpyrimidine-2,4(1H,3H)-dione

Database identifiers

CAS: 145414-66-0
PubChem CID: 455202
DTXSID: DTXSID40163007
ChEMBL: CHEMBL146798

Properties

Computed structural properties

XLogP: -2.4
Topological polar surface area: 88.1 Å²
Hydrogen bond donors: 2
Hydrogen bond acceptors: 5
Rotatable bonds: 2
Heavy atoms: 16
Formal charge: 0
Complexity: 354

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Compound notes

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