Chemical ID: 6299427

c1cc(ccc1C2CC2C(=O)O)Cl
Chemical ID:
6299427
Name [?]:
2-(4-chlorophenyl)cyclopropane-1-carboxylic acid
SMILES [?]:
c1cc(ccc1C2CC2C(=O)O)Cl
InChi [?]:
InChI=1/C10H9ClO2/c11-7-3-1-6(2-4-7)8-5-9(8)10(12)13/h1-4,8-9H,5H2,(H,12,13)
InChi Info:
AuxInfo=1/1/N:1,5,2,4,8,6,3,7,9,10,13,11,12/E:(1,2)(3,4)(12,13)/rA:13cCCCCCCCCCCOOCl/rB:s1;d2;s3;d4;d1s5;s6;s7;s7s8;s9;d10;s10;s3;/rC:;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C10H9ClO2
All Atoms:13
Heavy Atoms:13
Chiral Atoms:2
ZAP Information [?]
Total:6.93306
Area:351.719
Solvation:-1.85991
Coulombic:-27.3716
Bond Count [?]
All:14
Single:10
Double:4
Rotors:2
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:196.63
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:2.13
LogP (Chemaxon):2.58

Name Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

ChemicalMix SourceExternal IDDescriptorValue

Experimental Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical MixSourceExternal IDDescriptorValue

Descriptor Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical MixSourceExternal IDDescriptorValue