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121850-72-4 | Phosphonic acid, P-[2-[(2-hydroxyethyl)amino]ethyl]-
CAS No: 121850-72-4 Catalog No: AG00165A MDL No:
Product Description
Catalog Number:
AG00165A
Chemical Name:
Phosphonic acid, P-[2-[(2-hydroxyethyl)amino]ethyl]-
CAS Number:
121850-72-4
Molecular Formula:
C4H12NO4P
Molecular Weight:
169.1161
IUPAC Name:
2-(2-hydroxyethylamino)ethylphosphonic acid
InChI:
InChI=1S/C4H12NO4P/c6-3-1-5-2-4-10(7,8)9/h5-6H,1-4H2,(H2,7,8,9)
InChI Key:
HXWPEJQSZSRZFT-UHFFFAOYSA-N
SMILES:
OCCNCCP(=O)(O)O
Properties
Complexity:
122
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
169.05g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
169.117g/mol
Monoisotopic Mass:
169.05g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
89.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-5
Literature
| Title | Journal |
|---|---|
| Structural analysis of the carbohydrate components of the outer membrane of the lipopolysaccharide-lacking cellulolytic ruminal bacterium Fibrobacter succinogenes S85. | European journal of biochemistry 20010601 |
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