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81201-16-3 | 1-Propanamine, 3-[3-(4-morpholinylmethyl)phenoxy]-
CAS No: 81201-16-3 Catalog No: AG005FB0 MDL No:
Product Description
Catalog Number:
AG005FB0
Chemical Name:
1-Propanamine, 3-[3-(4-morpholinylmethyl)phenoxy]-
CAS Number:
81201-16-3
Molecular Formula:
C14H22N2O2
Molecular Weight:
250.3367
IUPAC Name:
3-[3-(morpholin-4-ylmethyl)phenoxy]propan-1-amine
InChI:
InChI=1S/C14H22N2O2/c15-5-2-8-18-14-4-1-3-13(11-14)12-16-6-9-17-10-7-16/h1,3-4,11H,2,5-10,12,15H2
InChI Key:
BPUOHUMZZKDGLM-UHFFFAOYSA-N
SMILES:
NCCCOc1cccc(c1)CN1CCOCC1
Properties
Complexity:
220
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
250.168g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
250.342g/mol
Monoisotopic Mass:
250.168g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
47.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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