Chemical ID: 6690781

CC1(CCCC2(C3C1C(C2CO)CC3)C)C
Chemical ID:
6690781
Name [?]:
None
SMILES [?]:
CC1(CCCC2(C3C1C(C2CO)CC3)C)C
InChi [?]:
InChI=1/C15H26O/c1-14(2)7-4-8-15(3)11-6-5-10(13(11)14)12(15)9-16/h10-13,16H,4-9H2,1-3H3
InChi Info:
AuxInfo=1/0/N:1,16,15,4,13,14,3,5,11,9,7,10,8,2,6,12/E:(1,2)/rA:16cCCCCCCCCCCCOCCCC/rB:s1;s2;s3;s4;s5;s6;s2s7;s8;s6s9;s10;s11;s9;s7s13;s6;s2;/rC:;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C15H26O
All Atoms:16
Heavy Atoms:16
Chiral Atoms:5
ZAP Information [?]
Total:7.77774
Area:363.925
Solvation:-1.32039
Coulombic:-19.0871
Bond Count [?]
All:18
Single:18
Double:0
Rotors:1
Chiral:0
Rigid Segments:2
Chemical Properties
Molecular Weight:222.366
H-Bond Donors:1
H-Bond Acceptors:1
XLogP:4.32
LogP (Chemaxon):3.54

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Descriptor Annotations

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