Home Other Building Blocks diethyl [(2,6-dimethylphenyl)methyl]phosphonate

diethyl [(2,6-dimethylphenyl)methyl]phosphonate

CAS No.:
902526-55-0
Catalog Number:
AG01B9O2
Molecular Formula:
C13H21O3P
Molecular Weight:
256.2778
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Product Description
Catalog Number:
AG01B9O2
Chemical Name:
diethyl [(2,6-dimethylphenyl)methyl]phosphonate
CAS Number:
902526-55-0
Molecular Formula:
C13H21O3P
Molecular Weight:
256.2778
MDL Number:
MFCD28383940
IUPAC Name:
2-(diethoxyphosphorylmethyl)-1,3-dimethylbenzene
InChI:
InChI=1S/C13H21O3P/c1-5-15-17(14,16-6-2)10-13-11(3)8-7-9-12(13)4/h7-9H,5-6,10H2,1-4H3
InChI Key:
YJKGTPLNMBMATG-UHFFFAOYSA-N
SMILES:
CCOP(=O)(Cc1c(C)cccc1C)OCC
Properties
Complexity:
247  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
256.123g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
256.282g/mol
Monoisotopic Mass:
256.123g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  
Properties