Chemical ID: 6617597

c1ccc(c(c1)COC(=O)c2ccccc2F)Cl
Chemical ID:
6617597
Name [?]:
(2-chlorophenyl)methyl 2-fluorobenzoate
SMILES [?]:
c1ccc(c(c1)COC(=O)c2ccccc2F)Cl
InChi [?]:
InChI=1/C14H10ClFO2/c15-12-7-3-1-5-10(12)9-18-14(17)11-6-2-4-8-13(11)16/h1-8H,9H2
InChi Info:
AuxInfo=1/0/N:1,13,2,14,6,12,3,15,7,5,11,4,16,9,18,17,10,8/rA:18nCCCCCCCOCOCCCCCCFCl/rB:s1;d2;s3;d4;d1s5;s5;s7;s8;d9;s9;s11;d12;s13;d14;d11s15;s16;s4;/rC:;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C14H10ClFO2
All Atoms:18
Heavy Atoms:18
Chiral Atoms:0
ZAP Information [?]
Total:8.36811
Area:440.883
Solvation:-2.65397
Coulombic:-26.2104
Bond Count [?]
All:19
Single:12
Double:7
Rotors:4
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:264.679
H-Bond Donors:0
H-Bond Acceptors:2
XLogP:4.45
LogP (Chemaxon):4.03

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Descriptor Annotations

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