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89020-96-2 | Phosphonic acid, (3-acetyloxiranyl)-, bis(1-methylethyl) ester
CAS No: 89020-96-2 Catalog No: AG0044D1 MDL No:
Product Description
Catalog Number:
AG0044D1
Chemical Name:
Phosphonic acid, (3-acetyloxiranyl)-, bis(1-methylethyl) ester
CAS Number:
89020-96-2
Molecular Formula:
C10H19O5P
Molecular Weight:
250.2286
IUPAC Name:
1-[3-di(propan-2-yloxy)phosphoryloxiran-2-yl]ethanone
InChI:
InChI=1S/C10H19O5P/c1-6(2)14-16(12,15-7(3)4)10-9(13-10)8(5)11/h6-7,9-10H,1-5H3
InChI Key:
XNSASXFQYQSLRP-UHFFFAOYSA-N
SMILES:
CC(OP(=O)(C1OC1C(=O)C)OC(C)C)C
Properties
Complexity:
298
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
250.097g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
250.231g/mol
Monoisotopic Mass:
250.097g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
65.1A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6
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