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Chemical ID: 5757745
Chemical ID:
5757745
Name [?]:
9-oxofluorene-4-carbonyl chloride
SMILES [?]:
c1ccc2c(c1)-c3c(cccc3C(=O)Cl)C2=O
InChi [?]:
InChI=1/C14H7ClO2/c15-14(17)11-7-3-6-10-12(11)8-4-1-2-5-9(8)13(10)16/h1-7H
InChi Info:
AuxInfo=1/0/N:1,2,10,6,3,9,11,5,4,8,12,7,16,13,15,17,14/rA:17nCCCCCCCCCCCCCOClCO/rB:s1;d2;s3;d4;d1s5;s5;s7;d8;s9;d10;d7s11;s12;d13;s13;s4s8;d16;/rC:;;;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C14H7ClO2 |
All Atoms: | 17 |
Heavy Atoms: | 17 |
Chiral Atoms: | 0 |
ZAP Information [?]
Total: | 7.92441 |
Area: | 395.827 |
Solvation: | -1.97127 |
Coulombic: | -20.7583 |
Bond Count [?]
All: | 19 |
Single: | 11 |
Double: | 8 |
Rotors: | 1 |
Chiral: | 0 |
Rigid Segments: | 2 |
Chemical Properties
Molecular Weight: | 242.657 |
H-Bond Donors: | 0 |
H-Bond Acceptors: | 2 |
XLogP: | 3.73 |
LogP (Chemaxon): | 2.9 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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