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141968-53-8 | Phosphonic acid, ethyl-, methyl 1-methylethyl ester (9CI)
CAS No: 141968-53-8 Catalog No: AG001HGC MDL No:
Product Description
Catalog Number:
AG001HGC
Chemical Name:
Phosphonic acid, ethyl-, methyl 1-methylethyl ester (9CI)
CAS Number:
141968-53-8
Molecular Formula:
C6H15O3P
Molecular Weight:
166.1553
IUPAC Name:
2-[ethyl(methoxy)phosphoryl]oxypropane
InChI:
InChI=1S/C6H15O3P/c1-5-10(7,8-4)9-6(2)3/h6H,5H2,1-4H3
InChI Key:
LUGLIABVQUMWPF-UHFFFAOYSA-N
SMILES:
CCP(=O)(OC(C)C)OC
Properties
Complexity:
133
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
166.076g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
166.157g/mol
Monoisotopic Mass:
166.076g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6
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