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53404-11-8 | 1H-Imidazole-1-ethanol, phosphate
CAS No: 53404-11-8 Catalog No: AG00DX66 MDL No:
Product Description
Catalog Number:
AG00DX66
Chemical Name:
1H-Imidazole-1-ethanol, phosphate
CAS Number:
53404-11-8
IUPAC Name:
2-imidazol-1-ylethanol;phosphoric acid
InChI:
InChI=1S/C5H8N2O.H3O4P/c8-4-3-7-2-1-6-5-7;1-5(2,3)4/h1-2,5,8H,3-4H2;(H3,1,2,3,4)
InChI Key:
KCHCFUUFLNACKP-UHFFFAOYSA-N
UNII:
46K2MA22WS
Properties
Complexity:
117
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
210.041g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
210.126g/mol
Monoisotopic Mass:
210.041g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
116A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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