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116596-47-5 | 2-Propanaminium, N,N,N-tris(1-methylethyl)-, perchlorate (1:1)
CAS No: 116596-47-5 Catalog No: AG000CUD MDL No:
Product Description
Catalog Number:
AG000CUD
Chemical Name:
2-Propanaminium, N,N,N-tris(1-methylethyl)-, perchlorate (1:1)
CAS Number:
116596-47-5
Molecular Formula:
C12H28ClNO4
Molecular Weight:
285.8080
IUPAC Name:
tetra(propan-2-yl)azanium;perchlorate
InChI:
InChI=1S/C12H28N.ClHO4/c1-9(2)13(10(3)4,11(5)6)12(7)8;2-1(3,4)5/h9-12H,1-8H3;(H,2,3,4,5)/q+1;/p-1
InChI Key:
XYJKGUCJRRDNNA-UHFFFAOYSA-M
SMILES:
[O-][Cl](=O)(=O)=O.CC([N+](C(C)C)(C(C)C)C(C)C)C
Properties
Complexity:
204
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
285.171g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
285.809g/mol
Monoisotopic Mass:
285.171g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
74.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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