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1240642-74-3 | 1-Naphthalenecarbonitrile, 5-amino-6-[3-(dimethylamino)phenyl]-
CAS No: 1240642-74-3 Catalog No: AG000LIF MDL No:MFCD23704788
Product Description
Catalog Number:
AG000LIF
Chemical Name:
1-Naphthalenecarbonitrile, 5-amino-6-[3-(dimethylamino)phenyl]-
CAS Number:
1240642-74-3
Molecular Formula:
C19H17N3
Molecular Weight:
287.3584
MDL Number:
MFCD23704788
IUPAC Name:
5-amino-6-[3-(dimethylamino)phenyl]naphthalene-1-carbonitrile
InChI:
InChI=1S/C19H17N3/c1-22(2)15-7-3-5-13(11-15)17-10-9-16-14(12-20)6-4-8-18(16)19(17)21/h3-11H,21H2,1-2H3
InChI Key:
XGQKLDDHNLZJRK-UHFFFAOYSA-N
SMILES:
N#Cc1cccc2c1ccc(c2N)c1cccc(c1)N(C)C
Properties
Complexity:
424
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
287.142g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
287.366g/mol
Monoisotopic Mass:
287.142g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
53A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4
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