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24588-98-5 | 1-Pyrrolidineethanol, α-[(2-phenoxyphenoxy)methyl]-
CAS No: 24588-98-5 Catalog No: AG002ONG MDL No:
Product Description
Catalog Number:
AG002ONG
Chemical Name:
1-Pyrrolidineethanol, α-[(2-phenoxyphenoxy)methyl]-
CAS Number:
24588-98-5
Molecular Formula:
C19H23NO3
Molecular Weight:
313.3908
IUPAC Name:
1-(2-phenoxyphenoxy)-3-pyrrolidin-1-ylpropan-2-ol
InChI:
InChI=1S/C19H23NO3/c21-16(14-20-12-6-7-13-20)15-22-18-10-4-5-11-19(18)23-17-8-2-1-3-9-17/h1-5,8-11,16,21H,6-7,12-15H2
InChI Key:
NNOZHRVXPMQOLS-UHFFFAOYSA-N
SMILES:
OC(CN1CCCC1)COc1ccccc1Oc1ccccc1
Properties
Complexity:
327
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
313.168g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
313.397g/mol
Monoisotopic Mass:
313.168g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
41.9A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
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