Chemical ID: 6668983

c1ccc(c(c1)NC(=O)Oc2ccc(cc2)C#N)Cl
Chemical ID:
6668983
Name [?]:
(4-cyanophenyl) (2-chlorophenyl)aminoformate
SMILES [?]:
c1ccc(c(c1)NC(=O)Oc2ccc(cc2)C#N)Cl
InChi [?]:
InChI=1/C14H9ClN2O2/c15-12-3-1-2-4-13(12)17-14(18)19-11-7-5-10(9-16)6-8-11/h1-8H,(H,17,18)
InChi Info:
AuxInfo=1/1/N:2,1,3,6,13,15,12,16,17,14,11,4,5,8,19,18,7,9,10/E:(5,6)(7,8)/rA:19nCCCCCCNCOOCCCCCCCNCl/rB:s1;d2;s3;d4;d1s5;s5;s7;d8;s8;s10;s11;d12;s13;d14;d11s15;s14;t17;s4;/rC:;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C14H9ClN2O2
All Atoms:19
Heavy Atoms:19
Chiral Atoms:0
ZAP Information [?]
Total:9.91968
Area:468.998
Solvation:-1.80527
Coulombic:-38.6098
Bond Count [?]
All:20
Single:12
Double:7
Rotors:4
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:272.686
H-Bond Donors:1
H-Bond Acceptors:4
XLogP:3.36
LogP (Chemaxon):4.01

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