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1251036-55-1 | 2-[Cyclopropyl-(4-fluoro-benzyl)-amino]-ethanol
CAS No: 1251036-55-1 Catalog No: AG01F9S9 MDL No:
Product Description
Catalog Number:
AG01F9S9
Chemical Name:
2-[Cyclopropyl-(4-fluoro-benzyl)-amino]-ethanol
CAS Number:
1251036-55-1
Molecular Formula:
C12H16FNO
Molecular Weight:
209.2599
IUPAC Name:
2-[cyclopropyl-[(4-fluorophenyl)methyl]amino]ethanol
InChI:
InChI=1S/C12H16FNO/c13-11-3-1-10(2-4-11)9-14(7-8-15)12-5-6-12/h1-4,12,15H,5-9H2
InChI Key:
PSCBHCQHYSTTRE-UHFFFAOYSA-N
SMILES:
OCCN(C1CC1)Cc1ccc(cc1)F
Properties
Complexity:
188
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
209.122g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
209.264g/mol
Monoisotopic Mass:
209.122g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
23.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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