Chemical ID: 3964543

CC(c1ccc2cc(ccc2c1)OC)C(=O)O[Na]
Chemical ID:
3964543
Name [?]:
2-(6-methoxy-2-naphthyl)propanoyloxysodium
SMILES [?]:
CC(c1ccc2cc(ccc2c1)OC)C(=O)O[Na]
InChi [?]:
InChI=1/C14H14O3.Na/c1-9(14(15)16)10-3-4-12-8-13(17-2)6-5-11(12)7-10;/h3-9H,1-2H3,(H,15,16);/q;+1/p-1
InChi Info:
AuxInfo=1/1/N:1,14,4,5,10,9,12,7,2,3,11,6,8,15,16,17,13;18/E:(15,16);/rA:18cCCCCCCCCCCCCOCCOONa/rB:s1;s2;s3;d4;s5;s6;d7;s8;d9;d6s10;d3s11;s8;s13;s2;d15;s15;s17;/rC:;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C14H13NaO3
All Atoms:18
Heavy Atoms:18
Chiral Atoms:1
ZAP Information [?]
Total:0.0
Area:0.0
Solvation:0.0
Coulombic:0.0
Bond Count [?]
All:19
Single:13
Double:6
Rotors:4
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:252.241
H-Bond Donors:0
H-Bond Acceptors:3
XLogP:2.87
LogP (Chemaxon):3.1

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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