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1353995-92-2 | 2-((S)-1-Methyl-pyrrolidin-3-ylamino)-ethanol
CAS No: 1353995-92-2 Catalog No: AG01FABQ MDL No:
Product Description
Catalog Number:
AG01FABQ
Chemical Name:
2-((S)-1-Methyl-pyrrolidin-3-ylamino)-ethanol
CAS Number:
1353995-92-2
Molecular Formula:
C7H16N2O
Molecular Weight:
144.2147
IUPAC Name:
2-[[(3S)-1-methylpyrrolidin-3-yl]amino]ethanol
InChI:
InChI=1S/C7H16N2O/c1-9-4-2-7(6-9)8-3-5-10/h7-8,10H,2-6H2,1H3/t7-/m0/s1
InChI Key:
IKWMXNFWLBZTKA-ZETCQYMHSA-N
SMILES:
OCCN[C@H]1CCN(C1)C
Properties
Complexity:
97.6
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
144.126g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
144.218g/mol
Monoisotopic Mass:
144.126g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.7
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