Chemical ID: 6832021

c1ccc2cc(ccc2c1)CC(=O)[O-]
Chemical ID:
6832021
Name [?]:
2-(2-naphthyl)acetate
SMILES [?]:
c1ccc2cc(ccc2c1)CC(=O)[O-]
InChi [?]:
InChI=1/C12H10O2/c13-12(14)8-9-5-6-10-3-1-2-4-11(10)7-9/h1-7H,8H2,(H,13,14)/p-1
InChi Info:
AuxInfo=1/1/N:1,2,10,3,7,8,5,11,6,9,4,12,13,14/E:(13,14)/rA:14nCCCCCCCCCCCCOO-/rB:s1;d2;s3;s4;d5;s6;d7;d4s8;d1s9;s6;s11;d12;s12;/rC:;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C12H9O2-
All Atoms:23
Heavy Atoms:14
Chiral Atoms:0
ZAP Information [?]
Total:-35.2345
Area:352.006
Solvation:-44.0346
Coulombic:-0.104415
Bond Count [?]
All:15
Single:9
Double:6
Rotors:2
Chiral:0
Rigid Segments:2
Chemical Properties
Molecular Weight:185.199
H-Bond Donors:0
H-Bond Acceptors:2
XLogP:2.23
LogP (Chemaxon):2.68

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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