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84300-72-1 | Morpholine, 4-[2-(1-naphthalenyl)-1-thioxoethyl]-
CAS No: 84300-72-1 Catalog No: AG0056NX MDL No:
Product Description
Catalog Number:
AG0056NX
Chemical Name:
Morpholine, 4-[2-(1-naphthalenyl)-1-thioxoethyl]-
CAS Number:
84300-72-1
Molecular Formula:
C16H17NOS
Molecular Weight:
271.3773
IUPAC Name:
1-morpholin-4-yl-2-naphthalen-1-ylethanethione
InChI:
InChI=1S/C16H17NOS/c19-16(17-8-10-18-11-9-17)12-14-6-3-5-13-4-1-2-7-15(13)14/h1-7H,8-12H2
InChI Key:
VRSUIPOWWMOBFR-UHFFFAOYSA-N
SMILES:
S=C(N1CCOCC1)Cc1cccc2c1cccc2
Properties
Complexity:
314
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
271.103g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
271.378g/mol
Monoisotopic Mass:
271.103g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
44.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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