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27674-49-3 | 4-Morpholinepropanol, β-[(3-methylbutoxy)methyl]-α,α-diphenyl-, hydrochloride (1:1)
CAS No: 27674-49-3 Catalog No: AG002UEQ MDL No:
Product Description
Catalog Number:
AG002UEQ
Chemical Name:
4-Morpholinepropanol, β-[(3-methylbutoxy)methyl]-α,α-diphenyl-, hydrochloride (1:1)
CAS Number:
27674-49-3
Molecular Formula:
C25H36ClNO3
Molecular Weight:
434.0112
IUPAC Name:
2-(3-methylbutoxymethyl)-3-morpholin-4-yl-1,1-diphenylpropan-1-ol;hydrochloride
InChI:
InChI=1S/C25H35NO3.ClH/c1-21(2)13-16-29-20-24(19-26-14-17-28-18-15-26)25(27,22-9-5-3-6-10-22)23-11-7-4-8-12-23;/h3-12,21,24,27H,13-20H2,1-2H3;1H
InChI Key:
RBBWKWGEMFMNLH-UHFFFAOYSA-N
SMILES:
CC(CCOCC(C(c1ccccc1)(c1ccccc1)O)CN1CCOCC1)C.Cl
Properties
Complexity:
419
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
433.238g/mol
Formal Charge:
0
Heavy Atom Count:
30
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
434.017g/mol
Monoisotopic Mass:
433.238g/mol
Rotatable Bond Count:
10
Topological Polar Surface Area:
41.9A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
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