Chemical ID: 6617887

CCCOC(=O)c1ccc(cc1)F
Chemical ID:
6617887
Name [?]:
propyl 4-fluorobenzoate
SMILES [?]:
CCCOC(=O)c1ccc(cc1)F
InChi [?]:
InChI=1/C10H11FO2/c1-2-7-13-10(12)8-3-5-9(11)6-4-8/h3-6H,2,7H2,1H3
InChi Info:
AuxInfo=1/0/N:1,2,8,12,9,11,3,7,10,5,13,6,4/E:(3,4)(5,6)/rA:13nCCCOCOCCCCCCF/rB:s1;s2;s3;s4;d5;s5;s7;d8;s9;d10;d7s11;s10;/rC:;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C10H11FO2
All Atoms:13
Heavy Atoms:13
Chiral Atoms:0
ZAP Information [?]
Total:6.76659
Area:358.378
Solvation:-2.19285
Coulombic:-24.8267
Bond Count [?]
All:13
Single:9
Double:4
Rotors:4
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:182.192
H-Bond Donors:0
H-Bond Acceptors:2
XLogP:2.9
LogP (Chemaxon):2.54

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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