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158586-36-8 | Morpholine, 4-(1-methylene-3-phenyl-2-propyn-1-yl)-
CAS No: 158586-36-8 Catalog No: AG001QBM MDL No:
Product Description
Catalog Number:
AG001QBM
Chemical Name:
Morpholine, 4-(1-methylene-3-phenyl-2-propyn-1-yl)-
CAS Number:
158586-36-8
Molecular Formula:
C14H15NO
Molecular Weight:
213.2750
IUPAC Name:
4-(4-phenylbut-1-en-3-yn-2-yl)morpholine
InChI:
InChI=1S/C14H15NO/c1-13(15-9-11-16-12-10-15)7-8-14-5-3-2-4-6-14/h2-6H,1,9-12H2
InChI Key:
UHRPAYBQPIACTK-UHFFFAOYSA-N
SMILES:
C=C(N1CCOCC1)C#Cc1ccccc1
Properties
Complexity:
297
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
213.115g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
213.28g/mol
Monoisotopic Mass:
213.115g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
12.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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