Chemical ID: 4585168

CC(C=Cc1ccccn1)O
Chemical ID:
4585168
Name [?]:
4-(2-pyridyl)but-3-en-2-ol
SMILES [?]:
CC(C=Cc1ccccn1)O
InChi [?]:
InChI=1/C9H11NO/c1-8(11)5-6-9-4-2-3-7-10-9/h2-8,11H,1H3
InChi Info:
AuxInfo=1/0/N:1,7,8,6,3,4,9,2,5,10,11/rA:11cCCCCCCCCCNO/rB:s1;s2;w3;s4;s5;d6;s7;d8;d5s9;s2;/rC:;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C9H11NO
All Atoms:11
Heavy Atoms:11
Chiral Atoms:1
ZAP Information [?]
Total:5.82722
Area:317.055
Solvation:-2.09915
Coulombic:-22.8685
Bond Count [?]
All:11
Single:7
Double:4
Rotors:2
Chiral:1
Rigid Segments:3
Chemical Properties
Molecular Weight:149.19
H-Bond Donors:1
H-Bond Acceptors:1
XLogP:1.18
LogP (Chemaxon):1.42

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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