Chemical ID: 5644692

c1cc2c3c(ccc(c3c1)C(=O)O)CC2
Chemical ID:
5644692
Name [?]:
acenaphthene-5-carboxylic acid
SMILES [?]:
c1cc2c3c(ccc(c3c1)C(=O)O)CC2
InChi [?]:
InChI=1/C13H10O2/c14-13(15)11-7-6-9-5-4-8-2-1-3-10(11)12(8)9/h1-3,6-7H,4-5H2,(H,14,15)
InChi Info:
AuxInfo=1/1/N:1,2,10,15,14,6,7,3,5,9,8,4,11,12,13/E:(14,15)/rA:15nCCCCCCCCCCCOOCC/rB:s1;d2;s3;s4;d5;s6;d7;d4s8;d1s9;s8;d11;s11;s5;s3s14;/rC:;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C13H10O2
All Atoms:15
Heavy Atoms:15
Chiral Atoms:0
ZAP Information [?]
Total:7.30576
Area:348.651
Solvation:-1.41051
Coulombic:-29.3569
Bond Count [?]
All:17
Single:11
Double:6
Rotors:1
Chiral:0
Rigid Segments:2
Chemical Properties
Molecular Weight:198.217
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:3.23
LogP (Chemaxon):3.0

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Descriptor Annotations

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