Chemical ID: 4702418

c1cc2c(cc1C(CC(=O)O)N)OCCO2
Chemical ID:
4702418
Name [?]:
3-amino-3-(2,5-dioxabicyclo[4.4.0]deca-6,8,10-trien-8-yl)propanoic acid
SMILES [?]:
c1cc2c(cc1C(CC(=O)O)N)OCCO2
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C11H13NO4
All Atoms:16
Heavy Atoms:16
Chiral Atoms:1
ZAP Information [?]
Total:5.84016
Area:391.358
Solvation:-3.9438
Coulombic:-53.8687
Bond Count [?]
All:17
Single:13
Double:4
Rotors:3
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:223.225
H-Bond Donors:3
H-Bond Acceptors:5
XLogP:0.41
LogP (Chemaxon):-2.02

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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