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27674-57-3 | 4-Morpholinepropanol, β-(ethoxymethyl)-α,α-diphenyl-, hydrochloride (1:1)
CAS No: 27674-57-3 Catalog No: AG002UEI MDL No:
Product Description
Catalog Number:
AG002UEI
Chemical Name:
4-Morpholinepropanol, β-(ethoxymethyl)-α,α-diphenyl-, hydrochloride (1:1)
CAS Number:
27674-57-3
Molecular Formula:
C22H30ClNO3
Molecular Weight:
391.9315
IUPAC Name:
2-(ethoxymethyl)-3-morpholin-4-yl-1,1-diphenylpropan-1-ol;hydrochloride
InChI:
InChI=1S/C22H29NO3.ClH/c1-2-25-18-21(17-23-13-15-26-16-14-23)22(24,19-9-5-3-6-10-19)20-11-7-4-8-12-20;/h3-12,21,24H,2,13-18H2,1H3;1H
InChI Key:
WQGCOKUHAKFRGU-UHFFFAOYSA-N
SMILES:
CCOCC(C(c1ccccc1)(c1ccccc1)O)CN1CCOCC1.Cl
Properties
Complexity:
367
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
391.191g/mol
Formal Charge:
0
Heavy Atom Count:
27
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
391.936g/mol
Monoisotopic Mass:
391.191g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
41.9A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
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