Chemical ID: 5046230

CCCCCCCCCCCCCCCCCC=O
Chemical ID:
5046230
Name [?]:
octadecanal
SMILES [?]:
CCCCCCCCCCCCCCCCCC=O
InChi [?]:
InChI=1/C18H36O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19/h18H,2-17H2,1H3
InChi Info:
AuxInfo=1/0/N:1,2,3,4,5,6,7,8,9,10,11,12,13,14,15,16,17,18,19/rA:19nCCCCCCCCCCCCCCCCCCO/rB:s1;s2;s3;s4;s5;s6;s7;s8;s9;s10;s11;s12;s13;s14;s15;s16;s17;d18;/rC:;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C18H36O
All Atoms:19
Heavy Atoms:19
Chiral Atoms:0
ZAP Information [?]
Total:13.0595
Area:596.792
Solvation:-1.86032
Coulombic:-10.8511
Bond Count [?]
All:18
Single:17
Double:1
Rotors:16
Chiral:0
Rigid Segments:9
Chemical Properties
Molecular Weight:268.478
H-Bond Donors:0
H-Bond Acceptors:1
XLogP:7.43
LogP (Chemaxon):5.99

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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