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14047-23-5 | Phosphonic acid, P-(1-aminopropyl)-
CAS No: 14047-23-5 Catalog No: AG0012GB MDL No:MFCD00015404
Product Description
Catalog Number:
AG0012GB
Chemical Name:
Phosphonic acid, P-(1-aminopropyl)-
CAS Number:
14047-23-5
Molecular Formula:
C3H10NO3P
Molecular Weight:
139.0902
MDL Number:
MFCD00015404
IUPAC Name:
1-aminopropylphosphonic acid
InChI:
InChI=1S/C3H10NO3P/c1-2-3(4)8(5,6)7/h3H,2,4H2,1H3,(H2,5,6,7)
InChI Key:
DELJNDWGTWHHFA-UHFFFAOYSA-N
SMILES:
CCC(P(=O)(O)O)N
NSC Number:
133879
Properties
Complexity:
109
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
139.04g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
139.091g/mol
Monoisotopic Mass:
139.04g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
83.6A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
-3.8
Literature
| Title | Journal |
|---|---|
| New aromatic monoesters of alpha-aminoaralkylphosphonic acids as inhibitors of aminopeptidase N/CD13. | Bioorganic & medicinal chemistry 20100415 |
| Diastereoselective fragmentation of chiral alpha-aminophosphonic acids/metal ion aggregates. | Journal of mass spectrometry : JMS 20060101 |
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