CAS: 5382-77-4
名称: diethyl oxane-4,4-dicarboxylate
SMILES:
CCOC(=O)C1(CCOCC1)C(=O)OCCMolecular Processing
Molecular formula
C11H18O5
Molecular weight
230.26
Exact mass
230.1154
XLogP
0.91
TPSA
61.83
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
4
Heavy atoms
16
Rings
1
Aromatic rings
0
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.818
Molar refractivity
55.75
Supplementary Information
InChIKey: ILUMJWCFQOFDMA-UHFFFAOYSA-N
同義語
Diethyl tetrahydropyran-4,4-dicarboxylate5382-77-4diethyl dihydro-2H-pyran-4,4(3H)-dicarboxylatediethyl oxane-4,4-dicarboxylatediethyl tetrahydro-4H-pyran-4,4-dicarboxylateMFCD018538624,4-DIETHYL OXANE-4,4-DICARBOXYLATE4,4-Bis(ethoxycarbonyl)tetrahydropyrantetrahydropyran-4,4-dicarboxylic acid diethyl esterSCHEMBL942419ILUMJWCFQOFDMA-UHFFFAOYSA-DTXSID10286338ILUMJWCFQOFDMA-UHFFFAOYSA-N4H-Pyran-4,4-dicarboxylic acid, tetrahydro-, diethyl esterNSC44889NSC-44889AKOS005622597VS-02746DB-032195CS-0322960Diethyl tetrahydro-2H-pyran-4,4-dicarboxylateF74844tetrahydro-pyran-4,4-dicarboxylic acid diethyl esterInChI=1/C11H18O5/c1-3-15-9(12)11(10(13)16-4-2)5-7-14-8-6-11/h3-8H2,1-2H3
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