General Information of the Compound
Compound ID
CP0098869
Compound Name
O-[(3-chlorophenyl)methyl]hydroxylamine;hydrochloride
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Structure
Formula
C7H9Cl2NO
Molecular Weight
194.061
Canonical SMILES
Cl.NOCc1cccc(Cl)c1
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InChI
InChI=1S/C7H8ClNO.ClH/c8-7-3-1-2-6(4-7)5-10-9;/h1-4H,5,9H2;1H
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InChIKey
PZPCEIVCWGWHCC-UHFFFAOYSA-N
Physicochemical Property
logP
2.1521
Rotatable Bonds
2
Heavy Atom Count
11
Polar Areas
35.25
Hydrogen Bond Donor Count
1
Hydrogen Bond Acceptor Count
2
Complexity
11

"RO5" indicates the cutoff set by lipinski's rule of five:

(1) Molecular weight less than 500 Dalton;

(2) xlogp less than 5;

(3) No more than 5 hbonddonor (Hydrogen Bond Donor Count);

(4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count);

(5) No more than 10 rotbonds (Rotatable Bond Count).

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PubChem ID
CID: 207299
ChEMBL ID
CHEMBL3765807