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14540-39-7 | Phosphonic acid, 1,1-dimethylethyl methyl ester
CAS No: 14540-39-7 Catalog No: AG001KV4 MDL No:
Product Description
Catalog Number:
AG001KV4
Chemical Name:
Phosphonic acid, 1,1-dimethylethyl methyl ester
CAS Number:
14540-39-7
Molecular Formula:
C5H13O3P
Molecular Weight:
152.1287
IUPAC Name:
methoxy-[(2-methylpropan-2-yl)oxy]-oxophosphanium
InChI:
InChI=1S/C5H12O3P/c1-5(2,3)8-9(6)7-4/h1-4H3/q+1
InChI Key:
RWQCCZKXETYGKE-UHFFFAOYSA-N
SMILES:
COP(=O)OC(C)(C)C
Properties
Complexity:
105
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
151.052g/mol
Formal Charge:
1
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
151.122g/mol
Monoisotopic Mass:
151.052g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1
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