Chemical ID: 4258597

CC(CN1CCCCCC1)O
Chemical ID:
4258597
Name [?]:
1-azepan-1-ylpropan-2-ol
SMILES [?]:
CC(CN1CCCCCC1)O
InChi [?]:
InChI=1/C9H19NO/c1-9(11)8-10-6-4-2-3-5-7-10/h9,11H,2-8H2,1H3
InChi Info:
AuxInfo=1/0/N:1,7,8,6,9,5,10,3,2,4,11/E:(2,3)(4,5)(6,7)/rA:11cCCCNCCCCCCO/rB:s1;s2;s3;s4;s5;s6;s7;s8;s4s9;s2;/rC:;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C9H19NO
All Atoms:11
Heavy Atoms:11
Chiral Atoms:1
ZAP Information [?]
Total:5.92171
Area:323.059
Solvation:-2.15477
Coulombic:-21.7031
Bond Count [?]
All:11
Single:11
Double:0
Rotors:2
Chiral:0
Rigid Segments:2
Chemical Properties
Molecular Weight:157.253
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:1.04
LogP (Chemaxon):1.25

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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