Chemical ID: 5179148

CC1=CCCCC1Oc2ccccc2
Chemical ID:
5179148
Name [?]:
(2-methyl-1-cyclohex-2-enyl)oxybenzene
SMILES [?]:
CC1=CCCCC1Oc2ccccc2
InChi [?]:
InChI=1/C13H16O/c1-11-7-5-6-10-13(11)14-12-8-3-2-4-9-12/h2-4,7-9,13H,5-6,10H2,1H3
InChi Info:
AuxInfo=1/0/N:1,12,11,13,4,5,3,10,14,6,2,9,7,8/E:(3,4)(8,9)/rA:14cCCCCCCCOCCCCCC/rB:s1;d2;s3;s4;s5;s2s6;s7;s8;s9;d10;s11;d12;d9s13;/rC:;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C13H16O
All Atoms:14
Heavy Atoms:14
Chiral Atoms:1
ZAP Information [?]
Total:7.22763
Area:352.873
Solvation:-1.59421
Coulombic:-10.6456
Bond Count [?]
All:15
Single:11
Double:4
Rotors:2
Chiral:0
Rigid Segments:2
Chemical Properties
Molecular Weight:188.266
H-Bond Donors:0
H-Bond Acceptors:1
XLogP:3.37
LogP (Chemaxon):3.42

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