Chemical ID: 4732057

c1cc2c(cc1[N+](=O)[O-])cc(s2)C(=O)Cl
Chemical ID:
4732057
Name [?]:
5-nitrobenzothiophene-2-carbonyl chloride
SMILES [?]:
c1cc2c(cc1[N+](=O)[O-])cc(s2)C(=O)Cl
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C9H4ClNO3S
All Atoms:15
Heavy Atoms:15
Chiral Atoms:0
ZAP Information [?]
Total:2.61598
Area:398.742
Solvation:-7.35256
Coulombic:-21.59
Bond Count [?]
All:16
Single:10
Double:6
Rotors:2
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:241.652
H-Bond Donors:0
H-Bond Acceptors:4
XLogP:2.39
LogP (Chemaxon):2.78

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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