Chemical ID: 5232971

COC(=O)C(=C)C1CCCC=C1
Chemical ID:
5232971
Name [?]:
methyl 2-(1-cyclohex-2-enyl)prop-2-enoate
SMILES [?]:
COC(=O)C(=C)C1CCCC=C1
InChi [?]:
InChI=1/C10H14O2/c1-8(10(11)12-2)9-6-4-3-5-7-9/h4,6,9H,1,3,5,7H2,2H3
InChi Info:
AuxInfo=1/0/N:6,1,10,11,9,12,8,5,7,3,4,2/rA:12cCOCOCCCCCCCC/rB:s1;s2;d3;s3;d5;s5;s7;s8;s9;s10;s7d11;/rC:;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C10H14O2
All Atoms:12
Heavy Atoms:12
Chiral Atoms:1
ZAP Information [?]
Total:6.83258
Area:331.097
Solvation:-1.44485
Coulombic:-21.9627
Bond Count [?]
All:12
Single:9
Double:3
Rotors:3
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:166.217
H-Bond Donors:0
H-Bond Acceptors:2
XLogP:2.61
LogP (Chemaxon):2.05

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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