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132186-00-6 | 1-Propanaminium, 3-chloro-2-hydroxy-N,N,N-tripropyl-, chloride (1:1)
CAS No: 132186-00-6 Catalog No: AG0010C5 MDL No:
Product Description
Catalog Number:
AG0010C5
Chemical Name:
1-Propanaminium, 3-chloro-2-hydroxy-N,N,N-tripropyl-, chloride (1:1)
CAS Number:
132186-00-6
Molecular Formula:
C12H27Cl2NO
Molecular Weight:
272.2549
IUPAC Name:
(3-chloro-2-hydroxypropyl)-tripropylazanium;chloride
InChI:
InChI=1S/C12H27ClNO.ClH/c1-4-7-14(8-5-2,9-6-3)11-12(15)10-13;/h12,15H,4-11H2,1-3H3;1H/q+1;/p-1
InChI Key:
UJGASLPMQXIPEY-UHFFFAOYSA-M
SMILES:
CCC[N+](CC(CCl)O)(CCC)CCC.[Cl-]
Properties
Complexity:
136
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
271.147g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
272.254g/mol
Monoisotopic Mass:
271.147g/mol
Rotatable Bond Count:
9
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
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