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6488-00-2 | 2-(3-Chlorophenoxy);ethanamine
CAS No: 6488-00-2 Catalog No: AG003ETM MDL No:MFCD00052976
Product Description
Catalog Number:
AG003ETM
Chemical Name:
2-(3-Chlorophenoxy);ethanamine
CAS Number:
6488-00-2
Molecular Formula:
C8H10ClNO
Molecular Weight:
171.6241
MDL Number:
MFCD00052976
IUPAC Name:
2-(3-chlorophenoxy)ethanamine
InChI:
InChI=1S/C8H10ClNO/c9-7-2-1-3-8(6-7)11-5-4-10/h1-3,6H,4-5,10H2
InChI Key:
SKLZUIZCCAYHOB-UHFFFAOYSA-N
SMILES:
NCCOc1cccc(c1)Cl
Properties
Complexity:
110
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
171.045g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
171.624g/mol
Monoisotopic Mass:
171.045g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
35.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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