Chemical ID: 5628961

CC=CC(=O)OCc1cc(=O)oc2c1ccc(c2)OC
Chemical ID:
5628961
Name [?]:
(7-methoxy-2-oxo-chromen-4-yl)methyl but-2-enoate
SMILES [?]:
CC=CC(=O)OCc1cc(=O)oc2c1ccc(c2)OC
InChi [?]:
InChI=1/C15H14O5/c1-3-4-14(16)19-9-10-7-15(17)20-13-8-11(18-2)5-6-12(10)13/h3-8H,9H2,1-2H3
InChi Info:
AuxInfo=1/0/N:1,20,2,3,16,15,9,18,7,8,17,14,13,4,10,5,11,19,6,12/rA:20nCCCCOOCCCCOOCCCCCCOC/rB:s1;w2;s3;d4;s4;s6;s7;d8;s9;d10;s10;s12;s8s13;d14;s15;d16;d13s17;s17;s19;/rC:;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C15H14O5
All Atoms:20
Heavy Atoms:20
Chiral Atoms:0
ZAP Information [?]
Total:7.62951
Area:472.309
Solvation:-4.17823
Coulombic:-45.3584
Bond Count [?]
All:21
Single:14
Double:7
Rotors:5
Chiral:1
Rigid Segments:5
Chemical Properties
Molecular Weight:274.269
H-Bond Donors:0
H-Bond Acceptors:4
XLogP:2.35
LogP (Chemaxon):2.56

Name Annotations

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Descriptor Annotations

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