Chemical ID: 6659769

c1ccc(cc1)C(C2CC2)(C(=O)O)N
Chemical ID:
6659769
Name [?]:
2-amino-2-cyclopropyl-2-phenyl-acetic acid
SMILES [?]:
c1ccc(cc1)C(C2CC2)(C(=O)O)N
InChi [?]:
InChI=1/C11H13NO2/c12-11(10(13)14,9-6-7-9)8-4-2-1-3-5-8/h1-5,9H,6-7,12H2,(H,13,14)
InChi Info:
AuxInfo=1/1/N:1,2,6,3,5,9,10,4,8,11,7,14,12,13/E:(2,3)(4,5)(6,7)(13,14)/rA:14cCCCCCCCCCCCOON/rB:s1;d2;s3;d4;d1s5;s4;s7;s8;s8s9;s7;d11;s11;s7;/rC:;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C11H13NO2
All Atoms:14
Heavy Atoms:14
Chiral Atoms:1
ZAP Information [?]
Total:7.09874
Area:352.698
Solvation:-1.7187
Coulombic:-42.1078
Bond Count [?]
All:15
Single:11
Double:4
Rotors:3
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:191.226
H-Bond Donors:3
H-Bond Acceptors:3
XLogP:-0.95
LogP (Chemaxon):-0.82

Name Annotations

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Descriptor Annotations

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