Chemical ID: 4120775

CC(C)(CC(=O)O)n1cccc1
Chemical ID:
4120775
Name [?]:
3-methyl-3-pyrrol-1-yl-butanoic acid
SMILES [?]:
CC(C)(CC(=O)O)n1cccc1
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C9H13NO2
All Atoms:12
Heavy Atoms:12
Chiral Atoms:0
ZAP Information [?]
Total:6.31616
Area:327.272
Solvation:-1.86563
Coulombic:-31.4402
Bond Count [?]
All:12
Single:9
Double:3
Rotors:3
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:167.205
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:1.54
LogP (Chemaxon):1.51

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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