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114846-55-8 | Diphosphoric acid, tetraethyl ester, mixt. with 1-naphthalenyl methylcarbamate (9CI)
CAS No: 114846-55-8 Catalog No: AG000FCJ MDL No:
Product Description
Catalog Number:
AG000FCJ
Chemical Name:
Diphosphoric acid, tetraethyl ester, mixt. with 1-naphthalenyl methylcarbamate (9CI)
CAS Number:
114846-55-8
IUPAC Name:
diethoxyphosphoryl diethyl phosphate;naphthalen-1-ylmethylcarbamic acid
InChI:
InChI=1S/C12H11NO2.C8H20O7P2/c14-12(15)13-8-10-6-3-5-9-4-1-2-7-11(9)10;1-5-11-16(9,12-6-2)15-17(10,13-7-3)14-8-4/h1-7,13H,8H2,(H,14,15);5-8H2,1-4H3
InChI Key:
GQNSSFNNMDCOIP-UHFFFAOYSA-N
Properties
Complexity:
475
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
491.147g/mol
Formal Charge:
0
Heavy Atom Count:
32
Hydrogen Bond Acceptor Count:
9
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
491.414g/mol
Monoisotopic Mass:
491.147g/mol
Rotatable Bond Count:
12
Topological Polar Surface Area:
130A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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