Chemical ID: 6525129

c1cc(cc(c1)F)C(=O)NCCCO
Chemical ID:
6525129
Name [?]:
3-fluoro-N-(3-hydroxypropyl)benzamide
SMILES [?]:
c1cc(cc(c1)F)C(=O)NCCCO
InChi [?]:
InChI=1/C10H12FNO2/c11-9-4-1-3-8(7-9)10(14)12-5-2-6-13/h1,3-4,7,13H,2,5-6H2,(H,12,14)
InChi Info:
AuxInfo=1/1/N:1,12,2,6,11,13,4,3,5,8,7,10,14,9/rA:14nCCCCCCFCONCCCO/rB:s1;d2;s3;d4;d1s5;s5;s3;d8;s8;s10;s11;s12;s13;/rC:;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C10H12FNO2
All Atoms:14
Heavy Atoms:14
Chiral Atoms:0
ZAP Information [?]
Total:5.87265
Area:381.197
Solvation:-3.65727
Coulombic:-42.1257
Bond Count [?]
All:14
Single:10
Double:4
Rotors:5
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:197.206
H-Bond Donors:2
H-Bond Acceptors:3
XLogP:1.24
LogP (Chemaxon):0.69

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