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2565-58-4 | P-(Chloromethyl)phosphonic acid
CAS No: 2565-58-4 Catalog No: AG0037QM MDL No:MFCD00013955
Product Description
Catalog Number:
AG0037QM
Chemical Name:
P-(Chloromethyl)phosphonic acid
CAS Number:
2565-58-4
Molecular Formula:
CH4ClO3P
Molecular Weight:
130.4674
MDL Number:
MFCD00013955
IUPAC Name:
chloromethylphosphonic acid
InChI:
InChI=1S/CH4ClO3P/c2-1-6(3,4)5/h1H2,(H2,3,4,5)
InChI Key:
MOFCYHDQWIZKMY-UHFFFAOYSA-N
SMILES:
ClCP(=O)(O)O
EC Number:
219-895-6
NSC Number:
30691
Properties
Complexity:
74.9
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
129.959g/mol
Formal Charge:
0
Heavy Atom Count:
6
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
130.464g/mol
Monoisotopic Mass:
129.959g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
57.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.9
Literature
| Title | Journal |
|---|---|
| Asymmetric synthesis of aziridine 2-phosphonates from enantiopure sulfinimines (N-sulfinyl imines). Synthesis of alpha-amino phosphonates. | The Journal of organic chemistry 20030321 |
| Synthesis of phosphoenol pyruvate (PEP) analogues and evaluation as inhibitors of PEP-utilizing enzymes. | European journal of biochemistry 20020701 |
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