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131444-73-0

131444-73-0 | Phosphoric acid, 1-methyl-2-oxopropyl bis(phenylmethyl) ester

CAS No: 131444-73-0 Catalog No: AG000W7I MDL No:

Product Description

Catalog Number:
AG000W7I
Chemical Name:
Phosphoric acid, 1-methyl-2-oxopropyl bis(phenylmethyl) ester
CAS Number:
131444-73-0
Molecular Formula:
C18H21O5P
Molecular Weight:
348.3301
IUPAC Name:
dibenzyl 3-oxobutan-2-yl phosphate
InChI:
InChI=1S/C18H21O5P/c1-15(19)16(2)23-24(20,21-13-17-9-5-3-6-10-17)22-14-18-11-7-4-8-12-18/h3-12,16H,13-14H2,1-2H3
InChI Key:
YMNGNTMAOPQPRG-UHFFFAOYSA-N
SMILES:
CC(=O)C(OP(=O)(OCc1ccccc1)OCc1ccccc1)C

Properties

Complexity:
401  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
348.113g/mol
Formal Charge:
0
Heavy Atom Count:
24  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
348.335g/mol
Monoisotopic Mass:
348.113g/mol
Rotatable Bond Count:
9  
Topological Polar Surface Area:
61.8A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7  

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