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27674-53-9 | 4-Morpholinepropanol, β-(methoxymethyl)-α,α-diphenyl-, hydrochloride (1:1)
CAS No: 27674-53-9 Catalog No: AG002UEM MDL No:
Product Description
Catalog Number:
AG002UEM
Chemical Name:
4-Morpholinepropanol, β-(methoxymethyl)-α,α-diphenyl-, hydrochloride (1:1)
CAS Number:
27674-53-9
Molecular Formula:
C21H28ClNO3
Molecular Weight:
377.9049
IUPAC Name:
2-(methoxymethyl)-3-morpholin-4-yl-1,1-diphenylpropan-1-ol;hydrochloride
InChI:
InChI=1S/C21H27NO3.ClH/c1-24-17-20(16-22-12-14-25-15-13-22)21(23,18-8-4-2-5-9-18)19-10-6-3-7-11-19;/h2-11,20,23H,12-17H2,1H3;1H
InChI Key:
KXSVJJLSZGWYCN-UHFFFAOYSA-N
SMILES:
COCC(C(c1ccccc1)(c1ccccc1)O)CN1CCOCC1.Cl
Properties
Complexity:
353
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
377.176g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
377.909g/mol
Monoisotopic Mass:
377.176g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
41.9A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
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