Chemical ID: 4950734

CC(C)(C(=O)c1ccccc1)Cl
Chemical ID:
4950734
Name [?]:
2-chloro-2-methyl-1-phenyl-propan-1-one
SMILES [?]:
CC(C)(C(=O)c1ccccc1)Cl
InChi [?]:
InChI=1/C10H11ClO/c1-10(2,11)9(12)8-6-4-3-5-7-8/h3-7H,1-2H3
InChi Info:
AuxInfo=1/0/N:1,3,9,8,10,7,11,6,4,2,12,5/E:(1,2)(4,5)(6,7)/rA:12nCCCCOCCCCCCCl/rB:s1;s2;s2;d4;s4;s6;d7;s8;d9;d6s10;s2;/rC:;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C10H11ClO
All Atoms:12
Heavy Atoms:12
Chiral Atoms:0
ZAP Information [?]
Total:7.1267
Area:336.148
Solvation:-1.277
Coulombic:-11.4704
Bond Count [?]
All:12
Single:8
Double:4
Rotors:2
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:182.646
H-Bond Donors:0
H-Bond Acceptors:1
XLogP:2.59
LogP (Chemaxon):2.69

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Descriptor Annotations

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