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129667-84-1 | 2-Naphthalenecarboxamide, 1-bromo-N,N-diethyl-
CAS No: 129667-84-1 Catalog No: AG000TL5 MDL No:
Product Description
Catalog Number:
AG000TL5
Chemical Name:
2-Naphthalenecarboxamide, 1-bromo-N,N-diethyl-
CAS Number:
129667-84-1
Molecular Formula:
C15H16BrNO
Molecular Weight:
306.1976
IUPAC Name:
1-bromo-N,N-diethylnaphthalene-2-carboxamide
InChI:
InChI=1S/C15H16BrNO/c1-3-17(4-2)15(18)13-10-9-11-7-5-6-8-12(11)14(13)16/h5-10H,3-4H2,1-2H3
InChI Key:
MGLQUHBKEKRYHN-UHFFFAOYSA-N
SMILES:
CCN(C(=O)c1ccc2c(c1Br)cccc2)CC
Properties
Complexity:
290
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
305.042g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
306.203g/mol
Monoisotopic Mass:
305.042g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
20.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.1
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