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4387-41-1 | Phosphorous acid, triphenyl ester, compd. with iodomethane (1:1)
CAS No: 4387-41-1 Catalog No: AG0072W1 MDL No:
Product Description
Catalog Number:
AG0072W1
Chemical Name:
Phosphorous acid, triphenyl ester, compd. with iodomethane (1:1)
CAS Number:
4387-41-1
Molecular Formula:
C19H18IO3P
Molecular Weight:
452.2227
IUPAC Name:
iodomethane;triphenyl phosphite
InChI:
InChI=1S/C18H15O3P.CH3I/c1-4-10-16(11-5-1)19-22(20-17-12-6-2-7-13-17)21-18-14-8-3-9-15-18;1-2/h1-15H;1H3
InChI Key:
AESFJDICLJFXLK-UHFFFAOYSA-N
SMILES:
c1ccc(cc1)OP(Oc1ccccc1)Oc1ccccc1.IC
Properties
Complexity:
249
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
452.004g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
452.228g/mol
Monoisotopic Mass:
452.004g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
27.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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