Chemical ID: 4683040

CC(c1ccccc1)NC(=O)CCl
Chemical ID:
4683040
Name [?]:
2-chloro-N-(1-phenylethyl)acetamide
SMILES [?]:
CC(c1ccccc1)NC(=O)CCl
InChi [?]:
InChI=1/C10H12ClNO/c1-8(12-10(13)7-11)9-5-3-2-4-6-9/h2-6,8H,7H2,1H3,(H,12,13)
InChi Info:
AuxInfo=1/1/N:1,6,5,7,4,8,12,2,3,10,13,9,11/E:(3,4)(5,6)/rA:13cCCCCCCCCNCOCCl/rB:s1;s2;s3;d4;s5;d6;d3s7;s2;s9;d10;s10;s12;/rC:;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C10H12ClNO
All Atoms:13
Heavy Atoms:13
Chiral Atoms:1
ZAP Information [?]
Total:7.10113
Area:379.107
Solvation:-2.37655
Coulombic:-22.0407
Bond Count [?]
All:13
Single:9
Double:4
Rotors:4
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:197.661
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:2.18
LogP (Chemaxon):1.99

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