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Chemical ID: 4123001
Chemical ID:
4123001
Name [?]:
[4-(hydroxymethyl)-2-(3-pyridyl)oxazolidin-4-yl]methanol
SMILES [?]:
c1cc(cnc1)C2NC(CO2)(CO)CO
InChi [?]:
InChI=1/C10H14N2O3/c13-5-10(6-14)7-15-9(12-10)8-2-1-3-11-4-8/h1-4,9,12-14H,5-7H2
InChi Info:
AuxInfo=1/0/N:1,2,6,4,12,14,10,3,7,9,5,8,13,15,11/E:(5,6)(13,14)/rA:15cCCCCNCCNCCOCOCO/rB:s1;d2;s3;d4;d1s5;s3;s7;s8;s9;s7s10;s9;s12;s9;s14;/rC:;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C10H14N2O3 |
All Atoms: | 15 |
Heavy Atoms: | 15 |
Chiral Atoms: | 1 |
ZAP Information [?]
Total: | 3.47002 |
Area: | 374.413 |
Solvation: | -5.89031 |
Coulombic: | -52.8288 |
Bond Count [?]
All: | 16 |
Single: | 13 |
Double: | 3 |
Rotors: | 3 |
Chiral: | 0 |
Rigid Segments: | 4 |
Chemical Properties
Molecular Weight: | 210.23 |
H-Bond Donors: | 3 |
H-Bond Acceptors: | 4 |
XLogP: | -1.26 |
LogP (Chemaxon): | -0.82 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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