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24463-95-4 | Pyridine, 3-methyl-, phosphate (1:1)
CAS No: 24463-95-4 Catalog No: AG002O84 MDL No:
Product Description
Catalog Number:
AG002O84
Chemical Name:
Pyridine, 3-methyl-, phosphate (1:1)
CAS Number:
24463-95-4
Molecular Formula:
C6H10NO4P
Molecular Weight:
191.1217
IUPAC Name:
3-methylpyridine;phosphoric acid
InChI:
InChI=1S/C6H7N.H3O4P/c1-6-3-2-4-7-5-6;1-5(2,3)4/h2-5H,1H3;(H3,1,2,3,4)
InChI Key:
QDCWUZBGJYOEEF-UHFFFAOYSA-N
SMILES:
OP(=O)(O)O.Cc1cccnc1
Properties
Complexity:
102
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
191.035g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
191.123g/mol
Monoisotopic Mass:
191.035g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
90.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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