Chemical ID: 4732011

c1cnc(c2c1occ2)Cl
Chemical ID:
4732011
Name [?]:
2-chloro-7-oxa-3-azabicyclo[4.3.0]nona-1,3,5,8-tetraene
SMILES [?]:
c1cnc(c2c1occ2)Cl
InChi [?]:
InChI=1/C7H4ClNO/c8-7-5-2-4-10-6(5)1-3-9-7/h1-4H
InChi Info:
AuxInfo=1/0/N:1,9,2,8,5,6,4,10,3,7/rA:10nCCNCCCOCCCl/rB:s1;d2;s3;d4;d1s5;s6;s7;s5d8;s4;/rC:;;;;;;;;;;

Chemical Details

Atom Count
Formula:C7H4ClNO
All Atoms:10
Heavy Atoms:10
Chiral Atoms:0
ZAP Information [?]
Total:5.48439
Area:290.487
Solvation:-1.7778
Coulombic:-12.5754
Bond Count [?]
All:11
Single:7
Double:4
Rotors:0
Chiral:0
Rigid Segments:1
Chemical Properties
Molecular Weight:153.566
H-Bond Donors:0
H-Bond Acceptors:0
XLogP:1.52
LogP (Chemaxon):2.2

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Descriptor Annotations

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