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20677-03-6 | Phosphonic acid, P-phenyl-, dipropyl ester
CAS No: 20677-03-6 Catalog No: AG002IP4 MDL No:
Product Description
Catalog Number:
AG002IP4
Chemical Name:
Phosphonic acid, P-phenyl-, dipropyl ester
CAS Number:
20677-03-6
Molecular Formula:
C12H19O3P
Molecular Weight:
242.2512
IUPAC Name:
dipropoxyphosphorylbenzene
InChI:
InChI=1S/C12H19O3P/c1-3-10-14-16(13,15-11-4-2)12-8-6-5-7-9-12/h5-9H,3-4,10-11H2,1-2H3
InChI Key:
PXGLYSITKOROKV-UHFFFAOYSA-N
SMILES:
CCCOP(=O)(c1ccccc1)OCCC
Properties
Complexity:
212
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
242.107g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
242.255g/mol
Monoisotopic Mass:
242.107g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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