Chemical ID: 4919975

c1ccc2cc3c(cc2c1)C4(c5ccccc5C(=O)C4(O3)O)O
Chemical ID:
4919975
Name [?]:
None
SMILES [?]:
c1ccc2cc3c(cc2c1)C4(c5ccccc5C(=O)C4(O3)O)O
InChi [?]:
InChI=1/C19H12O4/c20-17-13-7-3-4-8-14(13)18(21)15-9-11-5-1-2-6-12(11)10-16(15)23-19(17,18)22/h1-10,21-22H
InChi Info:
AuxInfo=1/0/N:1,2,15,14,10,3,16,13,8,5,9,4,17,12,7,6,18,11,20,19,23,22,21/rA:23cCCCCCCCCCCCCCCCCCCOCOOO/rB:s1;d2;s3;s4;d5;s6;d7;d4s8;d1s9;s7;s11;s12;d13;s14;d15;d12s16;s17;d18;s11s18;s6s20;s20;s11;/rC:;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C19H12O4
All Atoms:23
Heavy Atoms:23
Chiral Atoms:2
ZAP Information [?]
Total:7.35839
Area:460.071
Solvation:-4.1434
Coulombic:-56.0071
Bond Count [?]
All:27
Single:18
Double:9
Rotors:0
Chiral:0
Rigid Segments:1
Chemical Properties
Molecular Weight:304.296
H-Bond Donors:2
H-Bond Acceptors:4
XLogP:3.01
LogP (Chemaxon):3.42

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Descriptor Annotations

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