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89863-71-8 | Benzenamine, 4-(1,3-dithian-2-ylidenephenylmethyl)-N,N-dimethyl-
CAS No: 89863-71-8 Catalog No: AG003W2Z MDL No:
Product Description
Catalog Number:
AG003W2Z
Chemical Name:
Benzenamine, 4-(1,3-dithian-2-ylidenephenylmethyl)-N,N-dimethyl-
CAS Number:
89863-71-8
Molecular Formula:
C19H21NS2
Molecular Weight:
327.5067
IUPAC Name:
4-[1,3-dithian-2-ylidene(phenyl)methyl]-N,N-dimethylaniline
InChI:
InChI=1S/C19H21NS2/c1-20(2)17-11-9-16(10-12-17)18(15-7-4-3-5-8-15)19-21-13-6-14-22-19/h3-5,7-12H,6,13-14H2,1-2H3
InChI Key:
DPJXUVPWESDYLI-UHFFFAOYSA-N
SMILES:
CN(c1ccc(cc1)C(=C1SCCCS1)c1ccccc1)C
Properties
Complexity:
369
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
327.112g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
327.504g/mol
Monoisotopic Mass:
327.112g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
53.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.7
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