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138192-39-9 | Ethanamine, 2-(1-pyrenylmethoxy)-
CAS No: 138192-39-9 Catalog No: AG00185B MDL No:
Product Description
Catalog Number:
AG00185B
Chemical Name:
Ethanamine, 2-(1-pyrenylmethoxy)-
CAS Number:
138192-39-9
Molecular Formula:
C19H17NO
Molecular Weight:
275.3444
IUPAC Name:
2-(pyren-1-ylmethoxy)ethanamine
InChI:
InChI=1S/C19H17NO/c20-10-11-21-12-16-7-6-15-5-4-13-2-1-3-14-8-9-17(16)19(15)18(13)14/h1-9H,10-12,20H2
InChI Key:
FYESTWXXIHJBQM-UHFFFAOYSA-N
SMILES:
NCCOCc1ccc2c3c1ccc1c3c(cc2)ccc1
Properties
Complexity:
358
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
275.131g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
275.351g/mol
Monoisotopic Mass:
275.131g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
35.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7
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