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131180-57-9 | 2-Pyrrolidinemethanol, α,α-bis(4-methoxyphenyl)-, (2S)-
CAS No: 131180-57-9 Catalog No: AG000VOA MDL No:MFCD08702731
Product Description
Catalog Number:
AG000VOA
Chemical Name:
2-Pyrrolidinemethanol, α,α-bis(4-methoxyphenyl)-, (2S)-
CAS Number:
131180-57-9
Molecular Formula:
C19H23NO3
Molecular Weight:
313.3908
MDL Number:
MFCD08702731
IUPAC Name:
bis(4-methoxyphenyl)-[(2S)-pyrrolidin-2-yl]methanol
InChI:
InChI=1S/C19H23NO3/c1-22-16-9-5-14(6-10-16)19(21,18-4-3-13-20-18)15-7-11-17(23-2)12-8-15/h5-12,18,20-21H,3-4,13H2,1-2H3/t18-/m0/s1
InChI Key:
DIHSOOPDCJLLHA-SFHVURJKSA-N
SMILES:
COc1ccc(cc1)C(c1ccc(cc1)OC)([C@@H]1CCCN1)O
Properties
Complexity:
336
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
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:
2
Isotope Atom Count:
0
Molecular Weight:
313.397g/mol
Monoisotopic Mass:
313.168g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
50.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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