Chemical ID: 4669361

COC(=C)c1ccccc1
Chemical ID:
4669361
Name [?]:
1-methoxyvinylbenzene
SMILES [?]:
COC(=C)c1ccccc1
InChi [?]:
InChI=1/C9H10O/c1-8(10-2)9-6-4-3-5-7-9/h3-7H,1H2,2H3
InChi Info:
AuxInfo=1/0/N:4,1,8,7,9,6,10,3,5,2/E:(4,5)(6,7)/rA:10nCOCCCCCCCC/rB:s1;s2;d3;s3;s5;d6;s7;d8;d5s9;/rC:;;;;;;;;;;

Chemical Details

Atom Count
Formula:C9H10O
All Atoms:10
Heavy Atoms:10
Chiral Atoms:0
ZAP Information [?]
Total:5.52677
Area:298.306
Solvation:-1.93089
Coulombic:-9.66974
Bond Count [?]
All:10
Single:6
Double:4
Rotors:2
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:134.175
H-Bond Donors:0
H-Bond Acceptors:1
XLogP:2.78
LogP (Chemaxon):1.6

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