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Chemical ID: 6657563
Chemical ID:
6657563
Name [?]:
2-hydroxyimino-2-phenyl-acetic acid
SMILES [?]:
c1ccc(cc1)C(=NO)C(=O)O
InChi [?]:
InChI=1/C8H7NO3/c10-8(11)7(9-12)6-4-2-1-3-5-6/h1-5,12H,(H,10,11)
InChi Info:
AuxInfo=1/1/N:1,2,6,3,5,4,7,10,8,11,12,9/E:(2,3)(4,5)(10,11)/rA:12nCCCCCCCNOCOO/rB:s1;d2;s3;d4;d1s5;s4;w7;s8;s7;d10;s10;/rC:;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C8H7NO3 |
All Atoms: | 12 |
Heavy Atoms: | 12 |
Chiral Atoms: | 0 |
ZAP Information [?]
Total: | 5.82898 |
Area: | 319.752 |
Solvation: | -2.16483 |
Coulombic: | -42.8588 |
Bond Count [?]
All: | 12 |
Single: | 7 |
Double: | 5 |
Rotors: | 2 |
Chiral: | 1 |
Rigid Segments: | 3 |
Chemical Properties
Molecular Weight: | 165.146 |
H-Bond Donors: | 2 |
H-Bond Acceptors: | 4 |
XLogP: | 1.49 |
LogP (Chemaxon): | 0.91 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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