Mrv0541 08091208232D          

  5  3  0  0  0  0            999 V2000
   -1.0312    0.3572    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2062    0.3572    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0312   -0.3572    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.2062   -0.3572    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.2705    0.0000    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  4  2  1  0  0  0  0
  4  3  1  0  0  0  0
M  END
> <DATABASE_ID>
M2MDB001923

> <DATABASE_NAME>
M2MDB

> <SMILES>
Cl.CCON

> <INCHI_IDENTIFIER>
InChI=1S/C2H7NO.ClH/c1-2-4-3;/h2-3H2,1H3;1H

> <INCHI_KEY>
NUXCOKIYARRTDC-UHFFFAOYSA-N

> <FORMULA>
C2H8ClNO

> <MOLECULAR_WEIGHT>
97.544

> <EXACT_MASS>
97.02944159

> <JCHEM_ACCEPTOR_COUNT>
2

> <JCHEM_AVERAGE_POLARIZABILITY>
6.6838757480605295

> <JCHEM_BIOAVAILABILITY>
1

> <JCHEM_DONOR_COUNT>
1

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
O-ethylhydroxylamine hydrochloride

> <JCHEM_LOGP>
-0.005727702333333418

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
0

> <JCHEM_PHYSIOLOGICAL_CHARGE>
0

> <JCHEM_PKA_STRONGEST_BASIC>
4.404654327123285

> <JCHEM_POLAR_SURFACE_AREA>
35.25

> <JCHEM_REFRACTIVITY>
17.0796

> <JCHEM_ROTATABLE_BOND_COUNT>
1

> <JCHEM_RULE_OF_FIVE>
1

> <JCHEM_TRADITIONAL_IUPAC>
O-ethylhydroxylamine hydrochloride

> <JCHEM_VEBER_RULE>
1

> <MET_ID>
ECMDB21528

> <GENERIC_NAME>
Ethoxyamine

$$$$