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17843-02-6 | Benzenamine, phosphate (2:1)
CAS No: 17843-02-6 Catalog No: AG00261T MDL No:
Product Description
Catalog Number:
AG00261T
Chemical Name:
Benzenamine, phosphate (2:1)
CAS Number:
17843-02-6
Molecular Formula:
C12H17N2O4P
Molecular Weight:
284.2481
IUPAC Name:
hydrogen phosphate;phenylazanium
InChI:
InChI=1S/2C6H7N.H3O4P/c2*7-6-4-2-1-3-5-6;1-5(2,3)4/h2*1-5H,7H2;(H3,1,2,3,4)
InChI Key:
WOJRIVUQVXCTJU-UHFFFAOYSA-N
SMILES:
OP(=O)(O)O.Nc1ccccc1.Nc1ccccc1
EC Number:
241-799-8
Properties
Complexity:
92.7
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
284.093g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
284.252g/mol
Monoisotopic Mass:
284.093g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
139A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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