Chemical ID: 6367325

COc1ccc(cc1)CNC(=O)CCl
Chemical ID:
6367325
Name [?]:
2-chloro-N-[(4-methoxyphenyl)methyl]acetamide
SMILES [?]:
COc1ccc(cc1)CNC(=O)CCl
InChi [?]:
InChI=1/C10H12ClNO2/c1-14-9-4-2-8(3-5-9)7-12-10(13)6-11/h2-5H,6-7H2,1H3,(H,12,13)
InChi Info:
AuxInfo=1/1/N:1,5,7,4,8,13,9,6,3,11,14,10,12,2/E:(2,3)(4,5)/rA:14nCOCCCCCCCNCOCCl/rB:s1;s2;s3;d4;s5;d6;d3s7;s6;s9;s10;d11;s11;s13;/rC:;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C10H12ClNO2
All Atoms:14
Heavy Atoms:14
Chiral Atoms:0
ZAP Information [?]
Total:6.27836
Area:401.705
Solvation:-3.76427
Coulombic:-28.0877
Bond Count [?]
All:14
Single:10
Double:4
Rotors:5
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:213.661
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:1.57
LogP (Chemaxon):1.33

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Descriptor Annotations

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