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1250729-50-0 | 2-[(2-Chloro-6-fluoro-benzyl)-methyl-amino]-ethanol
CAS No: 1250729-50-0 Catalog No: AG01F8PR MDL No:
Product Description
Catalog Number:
AG01F8PR
Chemical Name:
2-[(2-Chloro-6-fluoro-benzyl)-methyl-amino]-ethanol
CAS Number:
1250729-50-0
Molecular Formula:
C10H13ClFNO
Molecular Weight:
217.6677
IUPAC Name:
2-[(2-chloro-6-fluorophenyl)methyl-methylamino]ethanol
InChI:
InChI=1S/C10H13ClFNO/c1-13(5-6-14)7-8-9(11)3-2-4-10(8)12/h2-4,14H,5-7H2,1H3
InChI Key:
FVXMORHPTJMSAR-UHFFFAOYSA-N
SMILES:
OCCN(Cc1c(F)cccc1Cl)C
Properties
Complexity:
170
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
217.067g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
217.668g/mol
Monoisotopic Mass:
217.067g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
23.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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