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1247478-71-2 | 2-[(3-Fluoro-benzyl)-isopropyl-amino]-ethanol
CAS No: 1247478-71-2 Catalog No: AG01FA9Q MDL No:
Product Description
Catalog Number:
AG01FA9Q
Chemical Name:
2-[(3-Fluoro-benzyl)-isopropyl-amino]-ethanol
CAS Number:
1247478-71-2
Molecular Formula:
C12H18FNO
Molecular Weight:
211.2758
IUPAC Name:
2-[(3-fluorophenyl)methyl-propan-2-ylamino]ethanol
InChI:
InChI=1S/C12H18FNO/c1-10(2)14(6-7-15)9-11-4-3-5-12(13)8-11/h3-5,8,10,15H,6-7,9H2,1-2H3
InChI Key:
NYIDRYXWMCUUMM-UHFFFAOYSA-N
SMILES:
OCCN(C(C)C)Cc1cccc(c1)F
Properties
Complexity:
175
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
211.137g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
211.28g/mol
Monoisotopic Mass:
211.137g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
23.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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