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102276-54-0 | Phosphonic acid, [(4S)-4-methyl-2-oxooctyl]-, dimethyl ester (9CI)
CAS No: 102276-54-0 Catalog No: AG00073K MDL No:
Product Description
Catalog Number:
AG00073K
Chemical Name:
Phosphonic acid, [(4S)-4-methyl-2-oxooctyl]-, dimethyl ester (9CI)
CAS Number:
102276-54-0
Molecular Formula:
C11H23O4P
Molecular Weight:
250.2717
IUPAC Name:
(4S)-1-dimethoxyphosphoryl-4-methyloctan-2-one
InChI:
InChI=1S/C11H23O4P/c1-5-6-7-10(2)8-11(12)9-16(13,14-3)15-4/h10H,5-9H2,1-4H3/t10-/m0/s1
InChI Key:
OGGRBKUQRPKXIC-JTQLQIEISA-N
SMILES:
CCCC[C@@H](CC(=O)CP(=O)(OC)OC)C
Properties
Complexity:
244
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
250.133g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
250.275g/mol
Monoisotopic Mass:
250.133g/mol
Rotatable Bond Count:
9
Topological Polar Surface Area:
52.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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