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88552-75-4 | 1-Propanamine, N,N-dimethyl-3-(octyloxy)-, hydrochloride
CAS No: 88552-75-4 Catalog No: AG004D6S MDL No:
Product Description
Catalog Number:
AG004D6S
Chemical Name:
1-Propanamine, N,N-dimethyl-3-(octyloxy)-, hydrochloride
CAS Number:
88552-75-4
Molecular Formula:
C13H30ClNO
Molecular Weight:
251.8364
IUPAC Name:
N,N-dimethyl-3-octoxypropan-1-amine;hydrochloride
InChI:
InChI=1S/C13H29NO.ClH/c1-4-5-6-7-8-9-12-15-13-10-11-14(2)3;/h4-13H2,1-3H3;1H
InChI Key:
LJIZNAQZEYQYRR-UHFFFAOYSA-N
SMILES:
CCCCCCCCOCCCN(C)C.Cl
Properties
Complexity:
115
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
251.202g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
251.839g/mol
Monoisotopic Mass:
251.202g/mol
Rotatable Bond Count:
11
Topological Polar Surface Area:
12.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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