Chemical ID: 3966619

CCCCCCCC=CCC#CC#CC(C=C)O
Chemical ID:
3966619
Name [?]:
heptadeca-1,9-dien-4,6-diyn-3-ol
SMILES [?]:
CCCCCCCC=CCC#CC#CC(C=C)O
InChi [?]:
InChI=1/C17H24O/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17(18)4-2/h4,10-11,17-18H,2-3,5-9,12H2,1H3
InChi Info:
AuxInfo=1/0/N:1,17,2,16,3,4,5,6,7,8,9,10,11,12,13,14,15,18/rA:18cCCCCCCCCCCCCCCCCCO/rB:s1;s2;s3;s4;s5;s6;s7;w8;s9;s10;t11;s12;t13;s14;s15;d16;s15;/rC:;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C17H24O
All Atoms:18
Heavy Atoms:18
Chiral Atoms:1
ZAP Information [?]
Total:12.2458
Area:557.167
Solvation:-1.68342
Coulombic:-22.9097
Bond Count [?]
All:17
Single:13
Double:2
Rotors:8
Chiral:1
Rigid Segments:6
Chemical Properties
Molecular Weight:244.372
H-Bond Donors:1
H-Bond Acceptors:1
XLogP:5.14
LogP (Chemaxon):5.02

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Descriptor Annotations

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