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89862-92-0 | Pyridine, 1,2,3,4-tetrahydro-1,6-dimethyl-5-(2-propenyl)-, perchlorate
CAS No: 89862-92-0 Catalog No: AG003W34 MDL No:
Product Description
Catalog Number:
AG003W34
Chemical Name:
Pyridine, 1,2,3,4-tetrahydro-1,6-dimethyl-5-(2-propenyl)-, perchlorate
CAS Number:
89862-92-0
Molecular Formula:
C10H18ClNO4
Molecular Weight:
251.7072
IUPAC Name:
1,6-dimethyl-5-prop-2-enyl-3,4-dihydro-2H-pyridine;perchloric acid
InChI:
InChI=1S/C10H17N.ClHO4/c1-4-6-10-7-5-8-11(3)9(10)2;2-1(3,4)5/h4H,1,5-8H2,2-3H3;(H,2,3,4,5)
InChI Key:
ZRALSWTUAPZGOZ-UHFFFAOYSA-N
SMILES:
O[Cl](=O)(=O)=O.C=CCC1=C(C)N(CCC1)C
Properties
Complexity:
293
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
251.092g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
251.707g/mol
Monoisotopic Mass:
251.092g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
74.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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