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106790-66-3 | 2-[Ethyl-(2-iodo-benzyl)-amino]-ethanol
CAS No: 106790-66-3 Catalog No: AG01FC65 MDL No:
Product Description
Catalog Number:
AG01FC65
Chemical Name:
2-[Ethyl-(2-iodo-benzyl)-amino]-ethanol
CAS Number:
106790-66-3
Molecular Formula:
C11H16INO
Molecular Weight:
305.1553
IUPAC Name:
2-[ethyl-[(2-iodophenyl)methyl]amino]ethanol
InChI:
InChI=1S/C11H16INO/c1-2-13(7-8-14)9-10-5-3-4-6-11(10)12/h3-6,14H,2,7-9H2,1H3
InChI Key:
NMJUJVPRJOIDJW-UHFFFAOYSA-N
SMILES:
OCCN(Cc1ccccc1I)CC
Properties
Complexity:
154
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
305.028g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
305.159g/mol
Monoisotopic Mass:
305.028g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
23.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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