Chemical ID: 6144686

CC(C)C(C(=O)O)NS(=O)(=O)c1ccccc1[N+](=O)[O-]
Chemical ID:
6144686
Name [?]:
3-methyl-2-(2-nitrophenyl)sulfonylamino-butanoic acid
SMILES [?]:
CC(C)C(C(=O)O)NS(=O)(=O)c1ccccc1[N+](=O)[O-]
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C11H14N2O6S
All Atoms:20
Heavy Atoms:20
Chiral Atoms:1
ZAP Information [?]
Total:2.32798
Area:431.086
Solvation:-8.44917
Coulombic:-48.0352
Bond Count [?]
All:20
Single:13
Double:7
Rotors:6
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:302.305
H-Bond Donors:2
H-Bond Acceptors:8
XLogP:1.2
LogP (Chemaxon):1.83

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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