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168971-56-0 | Benzenemethanamine, 2-(phenoxymethyl)-
CAS No: 168971-56-0 Catalog No: AG001YEX MDL No:MFCD04108110
Product Description
Catalog Number:
AG001YEX
Chemical Name:
Benzenemethanamine, 2-(phenoxymethyl)-
CAS Number:
168971-56-0
Molecular Formula:
C14H15NO
Molecular Weight:
213.2750
MDL Number:
MFCD04108110
IUPAC Name:
[2-(phenoxymethyl)phenyl]methanamine
InChI:
InChI=1S/C14H15NO/c15-10-12-6-4-5-7-13(12)11-16-14-8-2-1-3-9-14/h1-9H,10-11,15H2
InChI Key:
KBMVPPBKGKRHKO-UHFFFAOYSA-N
SMILES:
NCc1ccccc1COc1ccccc1
Properties
Complexity:
189
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
213.115g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
213.28g/mol
Monoisotopic Mass:
213.115g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
35.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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