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Chemical ID: 7226635
Chemical ID:
7226635
Name [?]:
4-hydroxy-2,3,4,5-tetrahydropyrrole-2-carboxylate
SMILES [?]:
C1C(C[NH2+]C1C(=O)[O-])O
InChi [?]:
InChI=1/C5H9NO3/c7-3-1-4(5(8)9)6-2-3/h3-4,6-7H,1-2H2,(H,8,9)
InChi Info:
AuxInfo=1/1/N:1,3,2,5,6,4,9,7,8/E:(8,9)/rA:9cCCCN+CCOO-O/rB:s1;s2;s3;s1s4;s5;d6;s6;s2;/rC:;;;;;;;;;
Chemical Details
Atom Count
Formula: | C5H9NO3 |
All Atoms: | 18 |
Heavy Atoms: | 9 |
Chiral Atoms: | None |
ZAP Information [?]
Total: | -28.6322 |
Area: | 274.15 |
Solvation: | -35.486 |
Coulombic: | -24.8051 |
Bond Count [?]
All: | 9 |
Single: | 8 |
Double: | 1 |
Rotors: | 1 |
Chiral: | None |
Rigid Segments: | None |
Chemical Properties
Molecular Weight: | None |
H-Bond Donors: | None |
H-Bond Acceptors: | None |
XLogP: | -1.7 |
LogP (Chemaxon): | None |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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