Chemical ID: 5496656

Cc1ccc(cc1)NC(=O)C(C)Cl
Chemical ID:
5496656
Name [?]:
2-chloro-N-(p-tolyl)propanamide
SMILES [?]:
Cc1ccc(cc1)NC(=O)C(C)Cl
InChi [?]:
InChI=1/C10H12ClNO/c1-7-3-5-9(6-4-7)12-10(13)8(2)11/h3-6,8H,1-2H3,(H,12,13)
InChi Info:
AuxInfo=1/1/N:1,12,3,7,4,6,2,11,5,9,13,8,10/E:(3,4)(5,6)/rA:13cCCCCCCCNCOCCCl/rB:s1;s2;d3;s4;d5;d2s6;s5;s8;d9;s9;s11;s11;/rC:;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C10H12ClNO
All Atoms:13
Heavy Atoms:13
Chiral Atoms:1
ZAP Information [?]
Total:7.35194
Area:374.429
Solvation:-2.00877
Coulombic:-21.5186
Bond Count [?]
All:13
Single:9
Double:4
Rotors:3
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:197.661
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:2.24
LogP (Chemaxon):2.97

Name Annotations

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Descriptor Annotations

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