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18812-42-5

18812-42-5 | Phosphonic acid, P-(phenylmethyl)-, dipropyl ester

CAS No: 18812-42-5 Catalog No: AG002GQC MDL No:

Product Description

Catalog Number:
AG002GQC
Chemical Name:
Phosphonic acid, P-(phenylmethyl)-, dipropyl ester
CAS Number:
18812-42-5
Molecular Formula:
C13H21O3P
Molecular Weight:
256.2778
IUPAC Name:
dipropoxyphosphorylmethylbenzene
InChI:
InChI=1S/C13H21O3P/c1-3-10-15-17(14,16-11-4-2)12-13-8-6-5-7-9-13/h5-9H,3-4,10-12H2,1-2H3
InChI Key:
AWAIEFLGOMEHGT-UHFFFAOYSA-N
SMILES:
CCCOP(=O)(Cc1ccccc1)OCCC

Properties

Complexity:
225  
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:
8  
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8  

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