Mrv1572004191602462D          

 10  8  0  0  0  0            999 V2000
   -0.4125    0.7145    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4125   -0.7145    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7145   -0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7145    0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2375    0.7145    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2375   -0.7145    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4289    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.4289   -0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0000    0.0000    0.0000 P   0  3  0  0  0  0  0  0  0  0  0  0
    3.7861    0.0000    0.0000 Cl  0  5  0  0  0  0  0  0  0  0  0  0
  5  1  1  0  0  0  0
  6  2  1  0  0  0  0
  7  3  1  0  0  0  0
  8  4  1  0  0  0  0
  9  1  1  0  0  0  0
  9  2  1  0  0  0  0
  9  3  1  0  0  0  0
  9  4  1  0  0  0  0
M  CHG  2   9   1  10  -1
M  END
> <DATABASE_ID>
CHEM009705

> <DATABASE_NAME>
chemdb

> <SMILES>
[Cl-].OC[P+](CO)(CO)CO

> <INCHI_IDENTIFIER>
InChI=1S/C4H12O4P.ClH/c5-1-9(2-6,3-7)4-8;/h5-8H,1-4H2;1H/q+1;/p-1

> <INCHI_KEY>
AKXUUJCMWZFYMV-UHFFFAOYSA-M

> <FORMULA>
C4H12ClO4P

> <MOLECULAR_WEIGHT>
190.56

> <EXACT_MASS>
190.0161736

> <JCHEM_ACCEPTOR_COUNT>
4

> <JCHEM_ATOM_COUNT>
22

> <JCHEM_AVERAGE_POLARIZABILITY>
13.998301356091186

> <JCHEM_BIOAVAILABILITY>
1

> <JCHEM_DONOR_COUNT>
4

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
tetrakis(hydroxymethyl)phosphanium chloride

> <ALOGPS_LOGP>
-1.72

> <JCHEM_LOGP>
-3.4872843053333336

> <ALOGPS_LOGS>
-0.88

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
0

> <JCHEM_PHYSIOLOGICAL_CHARGE>
1

> <JCHEM_PKA>
14.547773422701496

> <JCHEM_PKA_STRONGEST_ACIDIC>
14.05901767295089

> <JCHEM_PKA_STRONGEST_BASIC>
-2.947044629644429

> <JCHEM_POLAR_SURFACE_AREA>
80.92

> <JCHEM_REFRACTIVITY>
33.1412

> <JCHEM_ROTATABLE_BOND_COUNT>
4

> <JCHEM_RULE_OF_FIVE>
1

> <ALOGPS_SOLUBILITY>
2.51e+01 g/l

> <JCHEM_TRADITIONAL_IUPAC>
tetrakis(hydroxymethyl)phosphanium chloride

> <JCHEM_VEBER_RULE>
0

> <NAME>
Tetrakis(hydroxymethyl)phosphonium chloride

> <CAS>
124-64-1

> <SYNONYMS>
tetrakis(hydroxymethyl)phosphanium chloride; tetrakis(hydroxymethyl)phosphonium

$$$$