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1275730-24-9 | 2-{[1-(3-Chloro-phenyl)-ethyl]-methyl-amino}-ethanol
CAS No: 1275730-24-9 Catalog No: AG01F8G1 MDL No:
Product Description
Catalog Number:
AG01F8G1
Chemical Name:
2-{[1-(3-Chloro-phenyl)-ethyl]-methyl-amino}-ethanol
CAS Number:
1275730-24-9
Molecular Formula:
C11H16ClNO
Molecular Weight:
213.7038
IUPAC Name:
2-[1-(3-chlorophenyl)ethyl-methylamino]ethanol
InChI:
InChI=1S/C11H16ClNO/c1-9(13(2)6-7-14)10-4-3-5-11(12)8-10/h3-5,8-9,14H,6-7H2,1-2H3
InChI Key:
AKQGXOAWWQTUCZ-UHFFFAOYSA-N
SMILES:
OCCN(C(c1cccc(c1)Cl)C)C
Properties
Complexity:
165
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
213.092g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
213.705g/mol
Monoisotopic Mass:
213.092g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
23.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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