ChemDB: Chemical Search
Download
Chemical ID: 7245492
Chemical ID:
7245492
Name [?]:
2-chloro-N,N-dimethyl-2-phenyl-acetamide
SMILES [?]:
CN(C)C(=O)C(c1ccccc1)Cl
InChi [?]:
InChI=1/C10H12ClNO/c1-12(2)10(13)9(11)8-6-4-3-5-7-8/h3-7,9H,1-2H3
InChi Info:
AuxInfo=1/0/N:1,3,10,9,11,8,12,7,6,4,13,2,5/E:(1,2)(4,5)(6,7)/rA:13cCNCCOCCCCCCCCl/rB:s1;s2;s2;d4;s4;s6;s7;d8;s9;d10;d7s11;s6;/rC:;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C10H12ClNO |
All Atoms: | 25 |
Heavy Atoms: | 13 |
Chiral Atoms: | 1 |
ZAP Information [?]
Total: | 7.09815 |
Area: | 365.406 |
Solvation: | -2.037 |
Coulombic: | -18.6403 |
Bond Count [?]
All: | 13 |
Single: | 9 |
Double: | 4 |
Rotors: | 3 |
Chiral: | 0 |
Rigid Segments: | 4 |
Chemical Properties
Molecular Weight: | 197.661 |
H-Bond Donors: | 0 |
H-Bond Acceptors: | 2 |
XLogP: | 1.58 |
LogP (Chemaxon): | 2.02 |
Name Annotations
Note: All annotations are abbreviated. For more detailed information please download chemical.
Chemical | Mix Source | External ID | Descriptor | Value |
---|
Experimental Annotations
Note: All annotations are abbreviated. For more detailed information please download chemical.
Chemical Mix | Source | External ID | Descriptor | Value |
---|
Descriptor Annotations
Note: All annotations are abbreviated. For more detailed information please download chemical.
Chemical Mix | Source | External ID | Descriptor | Value |
---|