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131180-52-4 | 2-Pyrrolidinemethanol, α,α-bis(4-methylphenyl)-, (2S)-
CAS No: 131180-52-4 Catalog No: AG000VOB MDL No:
Product Description
Catalog Number:
AG000VOB
Chemical Name:
2-Pyrrolidinemethanol, α,α-bis(4-methylphenyl)-, (2S)-
CAS Number:
131180-52-4
Molecular Formula:
C19H23NO
Molecular Weight:
281.3920
IUPAC Name:
bis(4-methylphenyl)-[(2S)-pyrrolidin-2-yl]methanol
InChI:
InChI=1S/C19H23NO/c1-14-5-9-16(10-6-14)19(21,18-4-3-13-20-18)17-11-7-15(2)8-12-17/h5-12,18,20-21H,3-4,13H2,1-2H3/t18-/m0/s1
InChI Key:
FFFPARXSSPKJIS-SFHVURJKSA-N
SMILES:
Cc1ccc(cc1)C(c1ccc(cc1)C)([C@@H]1CCCN1)O
Properties
Complexity:
305
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
281.178g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
281.399g/mol
Monoisotopic Mass:
281.178g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
32.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
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