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834883-85-1 | 2-Thiophenecarboxaldehyde, 5-[(2-anthracenylimino)methyl]-
CAS No: 834883-85-1 Catalog No: AG0059VX MDL No:
Product Description
Catalog Number:
AG0059VX
Chemical Name:
2-Thiophenecarboxaldehyde, 5-[(2-anthracenylimino)methyl]-
CAS Number:
834883-85-1
Molecular Formula:
C20H13NOS
Molecular Weight:
315.3883
IUPAC Name:
5-(anthracen-2-yliminomethyl)thiophene-2-carbaldehyde
InChI:
InChI=1S/C20H13NOS/c22-13-20-8-7-19(23-20)12-21-18-6-5-16-9-14-3-1-2-4-15(14)10-17(16)11-18/h1-13H
InChI Key:
SSFLCZDJRLHIPN-UHFFFAOYSA-N
SMILES:
O=Cc1ccc(s1)C=Nc1ccc2c(c1)cc1c(c2)cccc1
Properties
Complexity:
451
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
315.072g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
315.39g/mol
Monoisotopic Mass:
315.072g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
57.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.5
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