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139640-65-6 | Naphtho[2,1-b]furan-1-amine, 1,2-dihydro-N-(4-methoxyphenyl)-
CAS No: 139640-65-6 Catalog No: AG001BFR MDL No:
Product Description
Catalog Number:
AG001BFR
Chemical Name:
Naphtho[2,1-b]furan-1-amine, 1,2-dihydro-N-(4-methoxyphenyl)-
CAS Number:
139640-65-6
Molecular Formula:
C19H17NO2
Molecular Weight:
291.3438
IUPAC Name:
N-(4-methoxyphenyl)-1,2-dihydrobenzo[e][1]benzofuran-1-amine
InChI:
InChI=1S/C19H17NO2/c1-21-15-9-7-14(8-10-15)20-17-12-22-18-11-6-13-4-2-3-5-16(13)19(17)18/h2-11,17,20H,12H2,1H3
InChI Key:
JQUASOPTLMEEIN-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)NC1COc2c1c1ccccc1cc2
Properties
Complexity:
366
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
291.126g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
291.35g/mol
Monoisotopic Mass:
291.126g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
30.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
4.4
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