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1261965-79-0 | Methanone, (2'-hydroxy[1,1'-biphenyl]-3-yl)-1-pyrrolidinyl-
CAS No: 1261965-79-0 Catalog No: AG000S98 MDL No:MFCD18313025
Product Description
Catalog Number:
AG000S98
Chemical Name:
Methanone, (2'-hydroxy[1,1'-biphenyl]-3-yl)-1-pyrrolidinyl-
CAS Number:
1261965-79-0
Molecular Formula:
C17H17NO2
Molecular Weight:
267.3224
MDL Number:
MFCD18313025
IUPAC Name:
[3-(2-hydroxyphenyl)phenyl]-pyrrolidin-1-ylmethanone
InChI:
InChI=1S/C17H17NO2/c19-16-9-2-1-8-15(16)13-6-5-7-14(12-13)17(20)18-10-3-4-11-18/h1-2,5-9,12,19H,3-4,10-11H2
InChI Key:
ZWWPWWNOGACCTG-UHFFFAOYSA-N
SMILES:
O=C(c1cccc(c1)c1ccccc1O)N1CCCC1
Properties
Complexity:
338
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
267.126g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
267.328g/mol
Monoisotopic Mass:
267.126g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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