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88024-15-1 | Phosphonic acid, (1-aminoethyl)-, diphenyl ester, hydrobromide
CAS No: 88024-15-1 Catalog No: AG004N55 MDL No:
Product Description
Catalog Number:
AG004N55
Chemical Name:
Phosphonic acid, (1-aminoethyl)-, diphenyl ester, hydrobromide
CAS Number:
88024-15-1
Molecular Formula:
C14H17BrNO3P
Molecular Weight:
358.1674
IUPAC Name:
1-diphenoxyphosphorylethanamine;hydrobromide
InChI:
InChI=1S/C14H16NO3P.BrH/c1-12(15)19(16,17-13-8-4-2-5-9-13)18-14-10-6-3-7-11-14;/h2-12H,15H2,1H3;1H
InChI Key:
VEXOSJBBZSHPKM-UHFFFAOYSA-N
SMILES:
CC(P(=O)(Oc1ccccc1)Oc1ccccc1)N.Br
Properties
Complexity:
288
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
357.013g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
358.172g/mol
Monoisotopic Mass:
357.013g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
61.6A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
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